cp2k-data 2.6.2-3 / usr / share / cp2k / EMSL_BASIS_SETS

# as currently required by QS, they are reordered so that no shell contains identical primitives.
#
#
# Citation: In addition to the original scientific reference,
# users of this form are requested to include the following citation
# in any publications resulting from its use:
# Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database,
# Version 02/25/04, as developed and distributed by the Molecular Science Computing Facility,
# Environmental and Molecular Sciences Laboratory which is part of the Pacific Northwest Laboratory,
# P.O. Box 999, Richland, Washington 99352, USA, and funded by the U.S. Department of Energy.
# The Pacific Northwest Laboratory is a multi-program laboratory operated by Battelle Memorial Institute
# for the U.S. Department of Energy under contract DE-AC06-76RLO 1830.
# Contact Karen Schuchardt for further information.
#
# Currently contains the following basis sets for the atoms H-Xe if present in the original database
#
# BASIS="3-21G*"
#Elements                             References
#--------                             ----------
# H - Ne: J.S. Binkley, J.A. Pople, W.J. Hehre, J. Am. Chem. Soc 102 939 (1980)
#Na - Ar: M.S. Gordon, J.S. Binkley, J.A. Pople, W.J. Pietro and W.J. Hehre,
#         J. Am. Chem. Soc. 104, 2797 (1983).
# K - Ca: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 7, 359 (1986).
#Ga - Kr: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 7, 359 (1986).
#Sc - Zn: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 8, 861 (1987).
# Y - Cd: K.D. Dobbs, W.J. Hehre, J. Comput. Chem. 8, 880 (1987).
#Cs     : A 3-21G quality set derived from the Huzinage MIDI basis sets.
#         E.D. Glendening and D. Feller, J. Phys. Chem. 99, 3060 (1995)
#Elements                             Reference
#--------                             ----------
#Na - Ar:  W.J. Pietro, M.M. Francl, W.J. Hehre, D.J. DeFrees, J.A. Pople and
#          J.S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982)
#
# HYDROGEN    (3s) -> [2s]
H  3-21Gx 3-21G*
  2
  1  0  0  2  1
          5.44717800          0.15628500
          0.82454700          0.90469100
  1  0  0  1  1
          0.18319200          1.00000000
# HELIUM      (3s) -> [2s]
HE 3-21Gx 3-21G*
  2
  1  0  0  2  1
         13.62670000          0.17523000
          1.99935000          0.89348300
  1  0  0  1  1
          0.38299300          1.00000000
# LITHIUM     (6s,3p) -> [3s,2p]
LI 3-21Gx 3-21G*
  3
  1  0  0  3  1
         36.83820000          0.06966860
          5.48172000          0.38134600
          1.11327000          0.68170200
  1  0  1  2  1  1
          0.54020500         -0.26312700          0.16154600
          0.10225500          1.14339000          0.91566300
  1  0  1  1  1  1
          0.02856500          1.00000000          1.00000000
# BERYLLIUM   (6s,3p) -> [3s,2p]
BE 3-21Gx 3-21G*
  3
  1  0  0  3  1
         71.88760000          0.06442630
         10.72890000          0.36609600
          2.22205000          0.69593400
  1  0  1  2  1  1
          1.29548000         -0.42106400          0.20513200
          0.26888100          1.22407000          0.88252800
  1  0  1  1  1  1
          0.07735000          1.00000000          1.00000000
# BORON       (6s,3p) -> [3s,2p]
B  3-21Gx 3-21G*
  3
  1  0  0  3  1
        116.43400000          0.06296050
         17.43140000          0.36330400
          3.68016000          0.69725500
  1  0  1  2  1  1
          2.28187000         -0.36866200          0.23115200
          0.46524800          1.19944000          0.86676400
  1  0  1  1  1  1
          0.12432800          1.00000000          1.00000000
# CARBON      (6s,3p) -> [3s,2p]
C  3-21Gx 3-21G*
  3
  1  0  0  3  1
        172.25600000          0.06176690
         25.91090000          0.35879400
          5.53335000          0.70071300
  1  0  1  2  1  1
          3.66498000         -0.39589700          0.23646000
          0.77054500          1.21584000          0.86061900
  1  0  1  1  1  1
          0.19585700          1.00000000          1.00000000
# NITROGEN    (6s,3p) -> [3s,2p]
N  3-21Gx 3-21G*
  3
  1  0  0  3  1
        242.76600000          0.05986570
         36.48510000          0.35295500
          7.81449000          0.70651300
  1  0  1  2  1  1
          5.42522000         -0.41330100          0.23797200
          1.14915000          1.22442000          0.85895300
  1  0  1  1  1  1
          0.28320500          1.00000000          1.00000000
# OXYGEN      (6s,3p) -> [3s,2p]
O  3-21Gx 3-21G*
  3
  1  0  0  3  1
        322.03700000          0.05923940
         48.43080000          0.35150000
         10.42060000          0.70765800
  1  0  1  2  1  1
          7.40294000         -0.40445300          0.24458600
          1.57620000          1.22156000          0.85395500
  1  0  1  1  1  1
          0.37368400          1.00000000          1.00000000
# FLUORINE    (6s,3p) -> [3s,2p]
F  3-21Gx 3-21G*
  3
  1  0  0  3  1
        413.80100000          0.05854830
         62.24460000          0.34930800
         13.43400000          0.70963200
  1  0  1  2  1  1
          9.77759000         -0.40732700          0.24668000
          2.08617000          1.22314000          0.85232100
  1  0  1  1  1  1
          0.48238300          1.00000000          1.00000000
# NEON        (6s,3p) -> [3s,2p]
NE 3-21Gx 3-21G*
  3
  1  0  0  3  1
        515.72400000          0.05814300
         77.65380000          0.34795100
         16.81360000          0.71071400
  1  0  1  2  1  1
         12.48300000         -0.40992200          0.24746000
          2.66451000          1.22431000          0.85174300
  1  0  1  1  1  1
          0.60625000          1.00000000          1.00000000
# SODIUM      (9s,6p) -> [4s,3p]
# SODIUM      (1d)
NA 3-21Gx 3-21G*
  5
  1  0  0  3  1
        547.61300000          0.06749110
         82.06780000          0.39350500
         17.69170000          0.66560500
  1  0  1  3  1  1
         17.54070000         -0.11193700          0.12823300
          3.79398000          0.25465400          0.47153300
          0.90644100          0.84441700          0.60427300
  1  0  1  2  1  1
          0.50182400         -0.21966000          0.00906650
          0.06094580          1.08912000          0.99720200
  1  0  1  1  1  1
          0.02443490          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (9s,6p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 3-21Gx 3-21G*
  5
  1  0  0  3  1
        652.84100000          0.06759820
         98.38050000          0.39177800
         21.29960000          0.66666100
  1  0  1  3  1  1
         23.37270000         -0.11024600          0.12101400
          5.19953000          0.18411900          0.46281000
          1.31508000          0.89639900          0.60690700
  1  0  1  2  1  1
          0.61134900         -0.36110100          0.02426330
          0.14184100          1.21505000          0.98667300
  1  0  1  1  1  1
          0.04640110          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (9s,6p) -> [4s,3p]
# ALUMINUM    (1d)
AL 3-21Gx 3-21G*
  5
  1  0  0  3  1
        775.73700000          0.06683470
        116.95200000          0.38906100
         25.33260000          0.66946800
  1  0  1  3  1  1
         29.47960000         -0.10790200          0.11757400
          6.63314000          0.14624500          0.46117400
          1.72675000          0.92373000          0.60553500
  1  0  1  2  1  1
          0.94616000         -0.32032700          0.05193830
          0.20250600          1.18412000          0.97266000
  1  0  1  1  1  1
          0.06390880          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (9s,6p) -> [4s,3p]
# SILICON     (1d)
SI 3-21Gx 3-21G*
  5
  1  0  0  3  1
        910.65500000          0.06608230
        137.33600000          0.38622900
         29.76010000          0.67238000
  1  0  1  3  1  1
         36.67160000         -0.10451100          0.11335500
          8.31729000          0.10741000          0.45757800
          2.21645000          0.95144600          0.60742700
  1  0  1  2  1  1
          1.07913000         -0.37610800          0.06710300
          0.30242200          1.25165000          0.95688300
  1  0  1  1  1  1
          0.09333920          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (9s,6p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  3-21Gx 3-21G*
  5
  1  0  0  3  1
       1054.90000000          0.06554100
        159.19500000          0.38403600
         34.53040000          0.67454100
  1  0  1  3  1  1
         44.28660000         -0.10213000          0.11085100
         10.10190000          0.08159200          0.45649500
          2.73997000          0.96978800          0.60693600
  1  0  1  2  1  1
          1.21865000         -0.37149500          0.09158200
          0.39554600          1.27099000          0.93492400
  1  0  1  1  1  1
          0.12281100          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (9s,6p) -> [4s,3p]
# SULFUR      (1d)
S  3-21Gx 3-21G*
  5
  1  0  0  3  1
       1210.62000000          0.06500700
        182.74700000          0.38204000
         39.66730000          0.67654500
  1  0  1  3  1  1
         52.22360000         -0.10031000          0.10964600
         11.96290000          0.06508800          0.45764900
          3.28911000          0.98145500          0.60426100
  1  0  1  2  1  1
          1.22384000         -0.28608900          0.16477700
          0.45730300          1.22806000          0.87085500
  1  0  1  1  1  1
          0.14226900          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (9s,6p) -> [4s,3p]
# CHLORINE    (1d)
CL 3-21Gx 3-21G*
  5
  1  0  0  3  1
       1376.40000000          0.06458270
        207.85700000          0.38036300
         45.15540000          0.67819000
  1  0  1  3  1  1
         60.80140000         -0.09876390          0.10859800
         13.97650000          0.05113380          0.45868200
          3.88710000          0.99133700          0.60196200
  1  0  1  2  1  1
          1.35299000         -0.22240100          0.21921600
          0.52695500          1.18252000          0.82232100
  1  0  1  1  1  1
          0.16671400          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (9s,6p) -> [4s,3p]
# ARGON       (1d)
AR 3-21Gx 3-21G*
  5
  1  0  0  3  1
       1553.71000000          0.06417070
        234.67800000          0.37879700
         51.01210000          0.67975200
  1  0  1  3  1  1
         70.04530000         -0.09746610          0.10761900
         16.14730000          0.03905690          0.45957600
          4.53492000          0.99991600          0.60004100
  1  0  1  2  1  1
          1.54209000         -0.17686600          0.25568700
          0.60726700          1.14690000          0.78984200
  1  0  1  1  1  1
          0.19537300          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# BASIS="6-31G*"
#Elements                             References
#--------                             ----------
# H - He: W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys. 56,
#Li - Ne: 2257 (1972).  Note: Li and B come from J.D. Dill and J.A.
#         Pople, J. Chem. Phys. 62, 2921 (1975).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon,
#         D.J. DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982)
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from the Gaussian
#         program
#Elements                             References
#--------                             ----------
#Li - Ne: P.C. Hariharan and J.A. Pople, Theoret. Chimica Acta 28, 213 (1973).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J.
#         DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982).
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from Gaussian.
#
# HYDROGEN    (4s) -> [2s]
H  6-31Gx 6-31G*
  2
  1  0  0  3  1
         18.73113700          0.03349460
          2.82539370          0.23472695
          0.64012170          0.81375733
  1  0  0  1  1
          0.16127780          1.00000000
# HELIUM      (4s) -> [2s]
HE 6-31Gx 6-31G*
  2
  1  0  0  3  1
         38.42163400          0.02376600
          5.77803000          0.15467900
          1.24177400          0.46963000
  1  0  0  1  1
          0.29796400          1.00000000
# LITHIUM     (10s,4p) -> [3s,2p]
# LITHIUM     (1d)
LI 6-31Gx 6-31G*
  4
  1  0  0  6  1
        642.41892000          0.00214260
         96.79851500          0.01620890
         22.09112100          0.07731560
          6.20107030          0.24578600
          1.93511770          0.47018900
          0.63673580          0.34547080
  1  0  1  3  1  1
          2.32491840         -0.03509170          0.00894150
          0.63243060         -0.19123280          0.14100950
          0.07905340          1.08398780          0.94536370
  1  0  1  1  1  1
          0.03596200          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (10s,4p) -> [3s,2p]
# BERYLLIUM   (1d)
BE 6-31Gx 6-31G*
  4
  1  0  0  6  1
       1264.58570000          0.00194480
        189.93681000          0.01483510
         43.15908900          0.07209060
         12.09866300          0.23715420
          3.80632320          0.46919870
          1.27289030          0.35652020
  1  0  1  3  1  1
          3.19646310         -0.11264870          0.05598020
          0.74781330         -0.22950640          0.26155060
          0.21996630          1.18691670          0.79397230
  1  0  1  1  1  1
          0.08230990          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
# BORON       (10s,4p) -> [3s,2p]
# BORON       (1d)
B  6-31Gx 6-31G*
  4
  1  0  0  6  1
       2068.88230000          0.00186630
        310.64957000          0.01425150
         70.68303300          0.06955160
         19.86108000          0.23257290
          6.29930480          0.46707870
          2.12702700          0.36343140
  1  0  1  3  1  1
          4.72797100         -0.13039380          0.07459760
          1.19033770         -0.13078890          0.30784670
          0.35941170          1.13094440          0.74345680
  1  0  1  1  1  1
          0.12675120          1.00000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
# CARBON      (10s,4p) -> [3s,2p]
C  6-31Gx 6-31G*
  4
  1  0  0  6  1
       3047.52490000          0.00183470
        457.36951000          0.01403730
        103.94869000          0.06884260
         29.21015500          0.23218440
          9.28666300          0.46794130
          3.16392700          0.36231200
  1  0  1  3  1  1
          7.86827240         -0.11933240          0.06899910
          1.88128850         -0.16085420          0.31642400
          0.54424930          1.14345640          0.74430830
  1  0  1  1  1  1
          0.16871440          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (10s,4p) -> [3s,2p]
# NITROGEN    (1d)
N  6-31Gx 6-31G*
  4
  1  0  0  6  1
       4173.51100000          0.00183480
        627.45790000          0.01399500
        142.90210000          0.06858700
         40.23433000          0.23224100
         12.82021000          0.46907000
          4.39043700          0.36045500
  1  0  1  3  1  1
         11.62635800         -0.11496100          0.06758000
          2.71628000         -0.16911800          0.32390700
          0.77221800          1.14585200          0.74089500
  1  0  1  1  1  1
          0.21203130          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# OXYGEN      (10s,4p) -> [3s,2p]
O  6-31Gx 6-31G*
  4
  1  0  0  6  1
       5484.67170000          0.00183110
        825.23495000          0.01395010
        188.04696000          0.06844510
         52.96450000          0.23271430
         16.89757000          0.47019300
          5.79963530          0.35852090
  1  0  1  3  1  1
         15.53961600         -0.11077750          0.07087430
          3.59993360         -0.14802630          0.33975280
          1.01376180          1.13076700          0.72715860
  1  0  1  1  1  1
          0.27000580          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# FLUORINE    (10s,4p) -> [3s,2p]
F  6-31Gx 6-31G*
  4
  1  0  0  6  1
       7001.71309000          0.00181962
       1051.36609000          0.01391608
        239.28569000          0.06840532
         67.39744530          0.23318576
         21.51995730          0.47126744
          7.40310130          0.35661855
  1  0  1  3  1  1
         20.84795280         -0.10850698          0.07162872
          4.80830834         -0.14645166          0.34591210
          1.34406986          1.12868858          0.72246996
  1  0  1  1  1  1
          0.35815139          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NEON        (10s,4p) -> [3s,2p]
# NEON        (1d)
NE 6-31Gx 6-31G*
  4
  1  0  0  6  1
       8425.85153000          0.00188435
       1268.51940000          0.01433690
        289.62141400          0.07010962
         81.85900400          0.23737327
         26.25150790          0.47300713
          9.09472051          0.34840124
  1  0  1  3  1  1
         26.53213100         -0.10711829          0.07190959
          6.10175501         -0.14616382          0.34951337
          1.69627153          1.12777350          0.71994051
  1  0  1  1  1  1
          0.44581870          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# SODIUM      (16s,10p) -> [4s,3p]
# SODIUM      (1d)
NA 6-31Gx 6-31G*
  5
  1  0  0  6  1
       9993.20000000          0.00193770
       1499.89000000          0.01480700
        341.95100000          0.07270600
         94.67970000          0.25262900
         29.73450000          0.49324200
         10.00630000          0.31316900
  1  0  1  6  1  1
        150.96300000         -0.00354210          0.00500170
         35.58780000         -0.04395900          0.03551100
         11.16830000         -0.10975210          0.14282500
          3.90201000          0.18739800          0.33862000
          1.38177000          0.64669900          0.45157900
          0.46638200          0.30605800          0.27327100
  1  0  1  3  1  1
          0.49796600         -0.24850300         -0.02302300
          0.08435300         -0.13170400          0.95035900
          0.06663500          1.23352000          0.05985800
  1  0  1  1  1  1
          0.02595440          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (16s,10p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 6-31Gx 6-31G*
  5
  1  0  0  6  1
      11722.80000000          0.00197780
       1759.93000000          0.01511400
        400.84600000          0.07391100
        112.80700000          0.24919100
         35.99970000          0.48792800
         12.18280000          0.31966200
  1  0  1  6  1  1
        189.18000000         -0.00323720          0.00492810
         45.21190000         -0.04100800          0.03498900
         14.35630000         -0.11260000          0.14072500
          5.13886000          0.14863300          0.33364200
          1.90652000          0.61649700          0.44494000
          0.70588700          0.36482900          0.26925400
  1  0  1  3  1  1
          0.92934000         -0.21229000         -0.02241900
          0.26903500         -0.10798500          0.19227000
          0.11737900          1.17584000          0.84618100
  1  0  1  1  1  1
          0.04210610          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (16s,10p) -> [4s,3p]
# ALUMINUM    (1d)
AL 6-31Gx 6-31G*
  5
  1  0  0  6  1
      13983.10000000          0.00194267
       2098.75000000          0.01485990
        477.70500000          0.07284940
        134.36000000          0.24683000
         42.87090000          0.48725800
         14.51890000          0.32349600
  1  0  1  6  1  1
        239.66800000         -0.00292619          0.00460285
         57.44190000         -0.03740800          0.03319900
         18.28590000         -0.11448700          0.13628200
          6.59914000          0.11563500          0.33047600
          2.49049000          0.61259500          0.44914600
          0.94454000          0.39379900          0.26570400
  1  0  1  3  1  1
          1.27790000         -0.22760600         -0.01751300
          0.39759000          0.00144583          0.24453300
          0.16009500          1.09279000          0.80493400
  1  0  1  1  1  1
          0.05565770          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (16s,10p) -> [4s,3p]
# SILICON     (1d)
SI 6-31Gx 6-31G*
  5
  1  0  0  6  1
      16115.90000000          0.00195948
       2425.58000000          0.01492880
        553.86700000          0.07284780
        156.34000000          0.24613000
         50.06830000          0.48591400
         17.01780000          0.32500200
  1  0  1  6  1  1
        292.71800000         -0.00278094          0.00443826
         69.87310000         -0.03571460          0.03266790
         22.33630000         -0.11498500          0.13472100
          8.15039000          0.09356340          0.32867800
          3.13458000          0.60301700          0.44964000
          1.22543000          0.41895900          0.26137200
  1  0  1  3  1  1
          1.72738000         -0.24463000         -0.01779510
          0.57292200          0.00431572          0.25353900
          0.22219200          1.09818000          0.80066900
  1  0  1  1  1  1
          0.07783690          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (16s,10p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  6-31Gx 6-31G*
  5
  1  0  0  6  1
      19413.30000000          0.00185160
       2909.42000000          0.01420620
        661.36400000          0.06999950
        185.75900000          0.24007900
         59.19430000          0.48476200
         20.03100000          0.33520000
  1  0  1  6  1  1
        339.47800000         -0.00278217          0.00456462
         81.01010000         -0.03604990          0.03369360
         25.87800000         -0.11663100          0.13975500
          9.45221000          0.09683280          0.33936200
          3.66566000          0.61441800          0.45092100
          1.46746000          0.40379800          0.23858600
  1  0  1  3  1  1
          2.15623000         -0.25292300         -0.01776530
          0.74899700          0.03285170          0.27405800
          0.28314500          1.08125000          0.78542100
  1  0  1  1  1  1
          0.09983170          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (16s,10p) -> [4s,3p]
# SULFUR      (1d)
S  6-31Gx 6-31G*
  5
  1  0  0  6  1
      21917.10000000          0.00186900
       3301.49000000          0.01423000
        754.14600000          0.06969600
        212.71100000          0.23848700
         67.98960000          0.48330700
         23.05150000          0.33807400
  1  0  1  6  1  1
        423.73500000         -0.00237670          0.00406100
        100.71000000         -0.03169300          0.03068100
         32.15990000         -0.11331700          0.13045200
         11.80790000          0.05609000          0.32720500
          4.63110000          0.59225500          0.45285100
          1.87025000          0.45500600          0.25604200
  1  0  1  3  1  1
          2.61584000         -0.25037400         -0.01451100
          0.92216700          0.06695700          0.31026300
          0.34128700          1.05451000          0.75448300
  1  0  1  1  1  1
          0.11716700          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (16s,10p) -> [4s,3p]
# CHLORINE    (1d)
CL 6-31Gx 6-31G*
  5
  1  0  0  6  1
      25180.10000000          0.00183300
       3780.35000000          0.01403400
        860.47400000          0.06909700
        242.14500000          0.23745200
         77.33490000          0.48303400
         26.24700000          0.33985600
  1  0  1  6  1  1
        491.76500000         -0.00229740          0.00398940
        116.98400000         -0.03071400          0.03031800
         37.41530000         -0.11252800          0.12988000
         13.78340000          0.04501600          0.32795100
          5.45215000          0.58935300          0.45352700
          2.22588000          0.46520600          0.25215400
  1  0  1  3  1  1
          3.18649000         -0.25183000         -0.01429900
          1.14427000          0.06158900          0.32357200
          0.42037700          1.06018000          0.74350700
  1  0  1  1  1  1
          0.14265700          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (16s,10p) -> [4s,3p]
# ARGON       (1d)
AR 6-31Gx 6-31G*
  5
  1  0  0  6  1
      28348.30000000          0.00182526
       4257.62000000          0.01396860
        969.85700000          0.06870730
        273.26300000          0.23620400
         87.36950000          0.48221400
         29.68670000          0.34204300
  1  0  1  6  1  1
        575.89100000         -0.00215972          0.00380665
        136.81600000         -0.02907750          0.02923050
         43.80980000         -0.11082700          0.12646700
         16.20940000          0.02769990          0.32351000
          6.46084000          0.57761300          0.45489600
          2.65114000          0.48868800          0.25663000
  1  0  1  3  1  1
          3.86028000         -0.25559200         -0.01591970
          1.41373000          0.03780660          0.32464600
          0.51664600          1.08056000          0.74399000
  1  0  1  1  1  1
          0.17388800          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# POTASSIUM   (22s,16p) -> [5s,4p]
# POTASSIUM   (1d)
K  6-31Gx 6-31G*
  6
  1  0  0  6  1
      31594.42000000          0.00182801
       4744.33000000          0.01399403
       1080.41900000          0.06887129
        304.23380000          0.23697600
         97.24586000          0.48290400
         33.02495000          0.34047950
  1  0  1  6  1  1
        622.76250000         -0.00250298          0.00409464
        147.88390000         -0.03315550          0.03145199
         47.32735000         -0.12263870          0.13515580
         17.51495000          0.05353643          0.33905000
          6.92272200          0.61938600          0.46294550
          2.76827700          0.43458780          0.22426380
  1  0  1  6  1  1
         11.84802000          0.01277689         -0.01221377
          4.07921100          0.20987670         -0.00690054
          1.76348100         -0.00309527          0.20074660
          0.78892700         -0.55938840          0.42813320
          0.35038700         -0.51347600          0.39701560
          0.14634400         -0.06598035          0.11047180
  1  0  1  3  1  1
          0.71680100         -0.05237772          0.03164300
          0.23374100         -0.27985030         -0.04046160
          0.03867500          1.14154700          1.01202900
  1  0  1  1  1  1
          0.01652100          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# CALCIUM     (22s,16p) -> [5s,4p]
# CALCIUM     (1d)
CA 6-31Gx 6-31G*
  6
  1  0  0  6  1
      35264.86000000          0.00181350
       5295.50300000          0.01388493
       1206.02000000          0.06836162
        339.68390000          0.23561880
        108.62640000          0.48206390
         36.92103000          0.34298190
  1  0  1  6  1  1
        706.30960000          0.00244823          0.00402037
        167.81870000          0.03241504          0.03100601
         53.82558000          0.12262190          0.13372790
         20.01638000         -0.04316965          0.33679830
          7.97027900         -0.61269950          0.46312810
          3.21205900         -0.44875400          0.22575320
  1  0  1  6  1  1
         14.19518000          0.01084500         -0.01289621
          4.88082800          0.20883330         -0.01025198
          2.16039000          0.03150338          0.19597810
          0.98789900         -0.55265180          0.43579330
          0.44951700         -0.54379970          0.39964520
          0.18738700         -0.06669342          0.09713636
  1  0  1  3  1  1
          1.03227100         -0.04439720         -0.42986210
          0.38117100         -0.32845630          0.00693583
          0.06513100          1.16301000          0.97059330
  1  0  1  1  1  1
          0.02601000          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# SCANDIUM    (22s,16p,4d) -> [5s,4p,2d]
# SCANDIUM    (1f)
SC 6-31Gx 6-31G*
  8
  1  0  0  6  1
      39088.98000000          0.00180326
       5869.79200000          0.01380769
       1336.91000000          0.06800396
        376.60310000          0.23470990
        120.46790000          0.48156900
         40.98032000          0.34456520
  1  0  1  6  1  1
        786.28520000          0.00245186          0.00403953
        186.88700000          0.03259579          0.03122570
         60.00935000          0.12382420          0.13498330
         22.25883000         -0.04359890          0.34247930
          8.88514900         -0.61771810          0.46231130
          3.60921100         -0.44328230          0.21775240
  1  0  1  6  1  1
         29.84355000         -0.00258630         -0.00609665
          9.54238300          0.07188424         -0.02628884
          4.05679000          0.25032600          0.05091001
          1.70470300         -0.29910030          0.37980970
          0.70623400         -0.74468180          0.51708830
          0.27953600         -0.17997760          0.18297720
  1  0  1  3  1  1
          1.06560900          0.06482978         -0.29384400
          0.42593300          0.32537560          0.09235323
          0.07632000         -1.17080600          0.98479300
  1  0  1  1  1  1
          0.02959400          1.00000000          1.00000000
  1  2  2  3  1
         11.14701000          0.08747672
          2.82104300          0.37956350
          0.81962000          0.71803930
  1  2  2  1  1
          0.22146800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# TITANIUM    (22s,16p,4d) -> [5s,4p,2d]
# TITANIUM    (1f)
TI 6-31Gx 6-31G*
  8
  1  0  0  6  1
      43152.95000000          0.00179187
       6479.57100000          0.01372392
       1475.67500000          0.06762830
        415.69910000          0.23376420
        133.00060000          0.48106960
         45.27222000          0.34622800
  1  0  1  6  1  1
        874.68260000          0.00243101          0.00401768
        207.97850000          0.03233027          0.03113966
         66.87918000          0.12425200          0.13490770
         24.87347000         -0.03903905          0.34316720
          9.96844100         -0.61717890          0.46257600
          4.06382600         -0.44730970          0.21546030
  1  0  1  6  1  1
         33.64363000         -0.00294036         -0.00631162
         10.87565000          0.07163103         -0.02697638
          4.62822500          0.25289150          0.05316847
          1.95012600         -0.29664010          0.38455490
          0.80945200         -0.74322150          0.51276620
          0.32047400         -0.18535200          0.18111350
  1  0  1  3  1  1
          1.22414800          0.06351465         -0.21120700
          0.48426300          0.31514040          0.07771998
          0.08409600         -1.16259500          0.98982140
  1  0  1  1  1  1
          0.03203600          1.00000000          1.00000000
  1  2  2  3  1
         13.69085000          0.08589418
          3.51315400          0.37846710
          1.04043400          0.71612390
  1  2  2  1  1
          0.28696200          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# VANADIUM    (22s,16p,4d) -> [5s,4p,2d]
# VANADIUM    (1f)
V  6-31Gx 6-31G*
  8
  1  0  0  6  1
      47354.33000000          0.00178451
       7110.78700000          0.01366754
       1619.59100000          0.06736122
        456.33790000          0.23305520
        146.06060000          0.48063160
         49.75791000          0.34748020
  1  0  1  6  1  1
        968.14840000          0.00241060          0.00399500
        230.28210000          0.03207243          0.03104061
         74.14591000          0.12459420          0.13477470
         27.64107000         -0.03482177          0.34372790
         11.11475000         -0.61673740          0.46287590
          4.54311300         -0.45098440          0.21355470
  1  0  1  6  1  1
         37.64050000         -0.00323320         -0.00649406
         12.28238000          0.07130744         -0.02753453
          5.23336600          0.25438200          0.05516284
          2.20895000         -0.29338870          0.38796720
          0.91788000         -0.74156950          0.50902580
          0.36341200         -0.19094100          0.18038400
  1  0  1  3  1  1
          1.39278100          0.06139703         -0.18912650
          0.54391300          0.30611300          0.08005453
          0.09147600         -1.15489000          0.98773990
  1  0  1  1  1  1
          0.03431200          1.00000000          1.00000000
  1  2  2  3  1
         16.05025000          0.08599899
          4.16006300          0.38029960
          1.24326500          0.71276590
  1  2  2  1  1
          0.34427700          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# CHROMIUM    (22s,16p,4d) -> [5s,4p,2d]
# CHROMIUM    (1f)
CR 6-31Gx 6-31G*
  8
  1  0  0  6  1
      51789.81000000          0.00177618
       7776.84900000          0.01360476
       1771.38500000          0.06706925
        499.15880000          0.23231040
        159.79820000          0.48024100
         54.47021000          0.34876530
  1  0  1  6  1  1
       1064.32800000          0.00239967          0.00398700
        253.21380000          0.03194886          0.03104662
         81.60924000          0.12508680          0.13505180
         30.48193000         -0.03221866          0.34488650
         12.29439000         -0.61722840          0.46285710
          5.03772200         -0.45259360          0.21104260
  1  0  1  6  1  1
         41.56291000         -0.00345422         -0.00672250
         13.67627000          0.07218428         -0.02806471
          5.84439000          0.25448200          0.05820028
          2.47160900         -0.29345340          0.39169880
          1.02830800         -0.73854550          0.50478230
          0.40725000         -0.19471570          0.17902900
  1  0  1  3  1  1
          1.57146400          0.05892219         -0.19301000
          0.60558000          0.29760550          0.09605620
          0.09856100         -1.14750600          0.98176090
  1  0  1  1  1  1
          0.03645900          1.00000000          1.00000000
  1  2  2  3  1
         18.41930000          0.08650816
          4.81266100          0.38266990
          1.44644700          0.70937720
  1  2  2  1  1
          0.40041300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# MANGANESE   (22s,16p,4d) -> [5s,4p,2d]
# MANGANESE   (1f)
MN 6-31Gx 6-31G*
  8
  1  0  0  6  1
      56347.14000000          0.00177158
       8460.94300000          0.01357081
       1927.32500000          0.06690605
        543.23430000          0.23185410
        173.99050000          0.47990460
         59.36005000          0.34957370
  1  0  1  6  1  1
       1165.41200000          0.00238875          0.00397732
        277.32760000          0.03181708          0.03103112
         89.47278000          0.12546700          0.13518940
         33.48256000         -0.02955431          0.34573870
         13.54037000         -0.61751600          0.46292050
          5.55797200         -0.45444580          0.20905920
  1  0  1  6  1  1
         45.83532000         -0.00366586         -0.00688758
         15.18777000          0.07231971         -0.02846816
          6.50071000          0.25444860          0.06031832
          2.75158300         -0.29103800          0.39389610
          1.14540400         -0.73598600          0.50137690
          0.45368700         -0.19976170          0.17922640
  1  0  1  3  1  1
          1.75799900          0.05628572         -0.50350240
          0.66702200          0.28974910          0.23450110
          0.10512900         -1.14065300          0.91412570
  1  0  1  1  1  1
          0.03841800          1.00000000          1.00000000
  1  2  2  3  1
         20.94355000          0.08672702
          5.51048600          0.38418830
          1.66503800          0.70690710
  1  2  2  1  1
          0.46173300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# IRON        (22s,16p,4d) -> [5s,4p,2d]
# IRON        (1f)
FE 6-31Gx 6-31G*
  8
  1  0  0  6  1
      61132.62000000          0.00176611
       9179.34200000          0.01353038
       2090.85700000          0.06673128
        589.24790000          0.23148230
        188.75430000          0.47970580
         64.44629000          0.35019760
  1  0  1  6  1  1
       1259.98000000          0.00243801          0.00402802
        299.87610000          0.03224048          0.03144647
         96.84917000          0.12657240          0.13683170
         36.31020000         -0.03139902          0.34872360
         14.72996000         -0.62075930          0.46179310
          6.06607500         -0.45029140          0.20430580
  1  0  1  6  1  1
         50.43485000         -0.00387326         -0.00701713
         16.83929000          0.07196598         -0.02877660
          7.19208600          0.25565910          0.06181383
          3.05342000         -0.28828370          0.39549460
          1.27364300         -0.73428220          0.49890590
          0.50409100         -0.20493530          0.17912510
  1  0  1  3  1  1
          1.95031600          0.05694869         -0.45937960
          0.73672100          0.28829150          0.28521390
          0.11417700         -1.13815900          0.90764850
  1  0  1  1  1  1
          0.04114800          1.00000000          1.00000000
  1  2  2  3  1
         23.14994000          0.08876935
          6.12236800          0.38963190
          1.84660100          0.70148160
  1  2  2  1  1
          0.50436100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COBALT      (22s,16p,4d) -> [5s,4p,2d]
# COBALT      (1f)
CO 6-31Gx 6-31G*
  8
  1  0  0  6  1
      66148.99000000          0.00175979
       9933.07700000          0.01348162
       2262.81600000          0.06649342
        637.91540000          0.23079390
        204.41220000          0.47929190
         69.82538000          0.35140970
  1  0  1  6  1  1
       1378.84100000          0.00237628          0.00397149
        328.26940000          0.03167450          0.03108174
        106.09460000          0.12628880          0.13574390
         39.83275000         -0.02584552          0.34768270
         16.18622000         -0.61834910          0.46263400
          6.66778800         -0.45670080          0.20516320
  1  0  1  6  1  1
         54.52355000         -0.00399300         -0.00729077
         18.29783000          0.07409663         -0.02926027
          7.86734800          0.25420000          0.06564150
          3.34053400         -0.29216570          0.40006520
          1.39375600         -0.73187030          0.49502360
          0.55132600         -0.20407840          0.17582400
  1  0  1  3  1  1
          2.15194700          0.05379843         -0.21654960
          0.81106300          0.27599710          0.12404880
          0.12101700         -1.12969200          0.97240640
  1  0  1  1  1  1
          0.04303700          1.00000000          1.00000000
  1  2  2  3  1
         25.59306000          0.09004748
          6.80099000          0.39317030
          2.05164700          0.69768440
  1  2  2  1  1
          0.55567100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# NICKEL      (22s,16p,4d) -> [5s,4p,2d]
# NICKEL      (1f)
NI 6-31Gx 6-31G*
  8
  1  0  0  6  1
      71396.35000000          0.00175300
      10720.84000000          0.01343122
       2442.12900000          0.06627041
        688.42650000          0.23025080
        220.61530000          0.47901860
         75.39373000          0.35234440
  1  0  1  6  1  1
       1492.53200000          0.00237071          0.00396755
        355.40130000          0.03160566          0.03109479
        114.95340000          0.12663350          0.13595170
         43.22043000         -0.02417037          0.34851360
         17.59710000         -0.61877750          0.46254980
          7.25776500         -0.45767700          0.20351860
  1  0  1  6  1  1
         59.35261000         -0.00416200         -0.00742145
         20.02181000          0.07425111         -0.02953410
          8.61456100          0.25413600          0.06731852
          3.66053100         -0.29034770          0.40166600
          1.52811100         -0.73021210          0.49266230
          0.60405700         -0.20760570          0.17568930
  1  0  1  3  1  1
          2.37927600          0.05157888         -0.18876630
          0.88583900          0.27076110          0.10151990
          0.12852900         -1.12477000          0.97909060
  1  0  1  1  1  1
          0.04519500          1.00000000          1.00000000
  1  2  2  3  1
         28.19147000          0.09098881
          7.52358400          0.39582080
          2.27122800          0.69471540
  1  2  2  1  1
          0.61160300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COPPER      (22s,16p,4d) -> [5s,4p,2d]
# COPPER      (1f)
CU 6-31Gx 6-31G*
  8
  1  0  0  6  1
      76794.38000000          0.00174816
      11530.70000000          0.01339602
       2626.57500000          0.06610885
        740.49030000          0.22982650
        237.35280000          0.47876750
         81.15818000          0.35307390
  1  0  1  6  1  1
       1610.81400000          0.00236405          0.00396331
        383.63670000          0.03153635          0.03110223
        124.17330000          0.12694520          0.13613500
         46.74678000         -0.02262840          0.34929140
         19.06569000         -0.61920800          0.46247800
          7.87156700         -0.45853930          0.20201020
  1  0  1  6  1  1
         64.45732000         -0.00433108         -0.00752373
         21.85212000          0.07412307         -0.02975687
          9.40534300          0.25421080          0.06849654
          3.99916800         -0.28748430          0.40271410
          1.67029700         -0.72914360          0.49084900
          0.65962700         -0.21139510          0.17592680
  1  0  1  3  1  1
          2.60008800          0.05027577         -0.17029110
          0.96309400          0.26500400          0.09310133
          0.13616100         -1.12015500          0.98143360
  1  0  1  1  1  1
          0.04733200          1.00000000          1.00000000
  1  2  2  3  1
         30.85341000          0.09199905
          8.26498500          0.39850210
          2.49533200          0.69178970
  1  2  2  1  1
          0.66765800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# ZINC        (22s,16p,4d) -> [5s,4p,2d]
# ZINC        (1f)
ZN 6-31Gx 6-31G*
  8
  1  0  0  6  1
      82400.94000000          0.00174333
      12372.55000000          0.01335966
       2818.35100000          0.06594365
        794.57170000          0.22941510
        254.72320000          0.47854530
         87.13880000          0.35377530
  1  0  1  6  1  1
       1732.56900000          0.00236146          0.00396313
        412.71490000          0.03150177          0.03113411
        133.67800000          0.12727740          0.13639310
         50.38585000         -0.02145928          0.35012660
         20.58358000         -0.61976520          0.46231790
          8.50594000         -0.45901800          0.20049950
  1  0  1  6  1  1
         69.36492000         -0.00444010         -0.00768926
         23.62082000          0.07505253         -0.02997982
         10.18471000          0.25331110          0.07082411
          4.33408200         -0.28818970          0.40461410
          1.81091800         -0.72670520          0.48823250
          0.71484100         -0.21334390          0.17519700
  1  0  1  3  1  1
          2.82384200          0.04898543         -0.15867630
          1.03954300          0.25927930          0.08379327
          0.14326400         -1.11571100          0.98405470
  1  0  1  1  1  1
          0.04929600          1.00000000          1.00000000
  1  2  2  3  1
         33.70764000          0.09262648
          9.06110600          0.40029800
          2.73838300          0.68966080
  1  2  2  1  1
          0.73029400          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# BASIS="6-31G**"
#Elements                             References
#--------                             ----------
# H - He: W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys. 56,
#Li - Ne: 2257 (1972).  Note: Li and B come from J.D. Dill and J.A.
#         Pople, J. Chem. Phys. 62, 2921 (1975).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon,
#         D.J. DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982)
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from the Gaussian
#         program
#Elements                             References
#--------                             ----------
#H,Li - Ne: P.C. Hariharan and J.A. Pople, Theoret. Chimica Acta 28, 213 (1973).
#
#Na - Ar  : M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J.
#
#           DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982).
#K  - Zn:   V.A. Rassolov, J.A. Pople, M.A. Ratner, and T.L. Windus
#           J. Chem. Phys. 109, 1223 (1998)
#           Note: He and Ne are unpublished basis sets taken from Gaussian.
#
# HYDROGEN    (4s) -> [2s]
# HYDROGEN    (1p)
H  6-31Gxx 6-31G**
  3
  1  0  0  3  1
         18.73113700          0.03349460
          2.82539370          0.23472695
          0.64012170          0.81375733
  1  0  0  1  1
          0.16127780          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# HELIUM      (4s) -> [2s]
# HELIUM      (1p)
HE 6-31Gxx 6-31G**
  3
  1  0  0  3  1
         38.42163400          0.02376600
          5.77803000          0.15467900
          1.24177400          0.46963000
  1  0  0  1  1
          0.29796400          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# LITHIUM     (10s,4p) -> [3s,2p]
# LITHIUM     (1d)
LI 6-31Gxx 6-31G**
  4
  1  0  0  6  1
        642.41892000          0.00214260
         96.79851500          0.01620890
         22.09112100          0.07731560
          6.20107030          0.24578600
          1.93511770          0.47018900
          0.63673580          0.34547080
  1  0  1  3  1  1
          2.32491840         -0.03509170          0.00894150
          0.63243060         -0.19123280          0.14100950
          0.07905340          1.08398780          0.94536370
  1  0  1  1  1  1
          0.03596200          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (10s,4p) -> [3s,2p]
# BERYLLIUM   (1d)
BE 6-31Gxx 6-31G**
  4
  1  0  0  6  1
       1264.58570000          0.00194480
        189.93681000          0.01483510
         43.15908900          0.07209060
         12.09866300          0.23715420
          3.80632320          0.46919870
          1.27289030          0.35652020
  1  0  1  3  1  1
          3.19646310         -0.11264870          0.05598020
          0.74781330         -0.22950640          0.26155060
          0.21996630          1.18691670          0.79397230
  1  0  1  1  1  1
          0.08230990          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
# BORON       (10s,4p) -> [3s,2p]
# BORON       (1d)
B  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       2068.88230000          0.00186630
        310.64957000          0.01425150
         70.68303300          0.06955160
         19.86108000          0.23257290
          6.29930480          0.46707870
          2.12702700          0.36343140
  1  0  1  3  1  1
          4.72797100         -0.13039380          0.07459760
          1.19033770         -0.13078890          0.30784670
          0.35941170          1.13094440          0.74345680
  1  0  1  1  1  1
          0.12675120          1.00000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
# CARBON      (10s,4p) -> [3s,2p]
C  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       3047.52490000          0.00183470
        457.36951000          0.01403730
        103.94869000          0.06884260
         29.21015500          0.23218440
          9.28666300          0.46794130
          3.16392700          0.36231200
  1  0  1  3  1  1
          7.86827240         -0.11933240          0.06899910
          1.88128850         -0.16085420          0.31642400
          0.54424930          1.14345640          0.74430830
  1  0  1  1  1  1
          0.16871440          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (10s,4p) -> [3s,2p]
N  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       4173.51100000          0.00183480
        627.45790000          0.01399500
        142.90210000          0.06858700
         40.23433000          0.23224100
         12.82021000          0.46907000
          4.39043700          0.36045500
  1  0  1  3  1  1
         11.62635800         -0.11496100          0.06758000
          2.71628000         -0.16911800          0.32390700
          0.77221800          1.14585200          0.74089500
  1  0  1  1  1  1
          0.21203130          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# OXYGEN      (10s,4p) -> [3s,2p]
O  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       5484.67170000          0.00183110
        825.23495000          0.01395010
        188.04696000          0.06844510
         52.96450000          0.23271430
         16.89757000          0.47019300
          5.79963530          0.35852090
  1  0  1  3  1  1
         15.53961600         -0.11077750          0.07087430
          3.59993360         -0.14802630          0.33975280
          1.01376180          1.13076700          0.72715860
  1  0  1  1  1  1
          0.27000580          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# FLUORINE    (10s,4p) -> [3s,2p]
F  6-31Gxx 6-31G**
  4
  1  0  0  6  1
       7001.71309000          0.00181962
       1051.36609000          0.01391608
        239.28569000          0.06840532
         67.39744530          0.23318576
         21.51995730          0.47126744
          7.40310130          0.35661855
  1  0  1  3  1  1
         20.84795280         -0.10850698          0.07162872
          4.80830834         -0.14645166          0.34591210
          1.34406986          1.12868858          0.72246996
  1  0  1  1  1  1
          0.35815139          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NEON        (10s,4p) -> [3s,2p]
# NEON        (1d)
NE 6-31Gxx 6-31G**
  4
  1  0  0  6  1
       8425.85153000          0.00188435
       1268.51940000          0.01433690
        289.62141400          0.07010962
         81.85900400          0.23737327
         26.25150790          0.47300713
          9.09472051          0.34840124
  1  0  1  3  1  1
         26.53213100         -0.10711829          0.07190959
          6.10175501         -0.14616382          0.34951337
          1.69627153          1.12777350          0.71994051
  1  0  1  1  1  1
          0.44581870          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# SODIUM      (16s,10p) -> [4s,3p]
# SODIUM      (1d)
NA 6-31Gxx 6-31G**
  5
  1  0  0  6  1
       9993.20000000          0.00193770
       1499.89000000          0.01480700
        341.95100000          0.07270600
         94.67970000          0.25262900
         29.73450000          0.49324200
         10.00630000          0.31316900
  1  0  1  6  1  1
        150.96300000         -0.00354210          0.00500170
         35.58780000         -0.04395900          0.03551100
         11.16830000         -0.10975210          0.14282500
          3.90201000          0.18739800          0.33862000
          1.38177000          0.64669900          0.45157900
          0.46638200          0.30605800          0.27327100
  1  0  1  3  1  1
          0.49796600         -0.24850300         -0.02302300
          0.08435300         -0.13170400          0.95035900
          0.06663500          1.23352000          0.05985800
  1  0  1  1  1  1
          0.02595440          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (16s,10p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      11722.80000000          0.00197780
       1759.93000000          0.01511400
        400.84600000          0.07391100
        112.80700000          0.24919100
         35.99970000          0.48792800
         12.18280000          0.31966200
  1  0  1  6  1  1
        189.18000000         -0.00323720          0.00492810
         45.21190000         -0.04100800          0.03498900
         14.35630000         -0.11260000          0.14072500
          5.13886000          0.14863300          0.33364200
          1.90652000          0.61649700          0.44494000
          0.70588700          0.36482900          0.26925400
  1  0  1  3  1  1
          0.92934000         -0.21229000         -0.02241900
          0.26903500         -0.10798500          0.19227000
          0.11737900          1.17584000          0.84618100
  1  0  1  1  1  1
          0.04210610          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (16s,10p) -> [4s,3p]
# ALUMINUM    (1d)
AL 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      13983.10000000          0.00194267
       2098.75000000          0.01485990
        477.70500000          0.07284940
        134.36000000          0.24683000
         42.87090000          0.48725800
         14.51890000          0.32349600
  1  0  1  6  1  1
        239.66800000         -0.00292619          0.00460285
         57.44190000         -0.03740800          0.03319900
         18.28590000         -0.11448700          0.13628200
          6.59914000          0.11563500          0.33047600
          2.49049000          0.61259500          0.44914600
          0.94454000          0.39379900          0.26570400
  1  0  1  3  1  1
          1.27790000         -0.22760600         -0.01751300
          0.39759000          0.00144583          0.24453300
          0.16009500          1.09279000          0.80493400
  1  0  1  1  1  1
          0.05565770          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (16s,10p) -> [4s,3p]
# SILICON     (1d)
SI 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      16115.90000000          0.00195948
       2425.58000000          0.01492880
        553.86700000          0.07284780
        156.34000000          0.24613000
         50.06830000          0.48591400
         17.01780000          0.32500200
  1  0  1  6  1  1
        292.71800000         -0.00278094          0.00443826
         69.87310000         -0.03571460          0.03266790
         22.33630000         -0.11498500          0.13472100
          8.15039000          0.09356340          0.32867800
          3.13458000          0.60301700          0.44964000
          1.22543000          0.41895900          0.26137200
  1  0  1  3  1  1
          1.72738000         -0.24463000         -0.01779510
          0.57292200          0.00431572          0.25353900
          0.22219200          1.09818000          0.80066900
  1  0  1  1  1  1
          0.07783690          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (16s,10p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  6-31Gxx 6-31G**
  5
  1  0  0  6  1
      19413.30000000          0.00185160
       2909.42000000          0.01420620
        661.36400000          0.06999950
        185.75900000          0.24007900
         59.19430000          0.48476200
         20.03100000          0.33520000
  1  0  1  6  1  1
        339.47800000         -0.00278217          0.00456462
         81.01010000         -0.03604990          0.03369360
         25.87800000         -0.11663100          0.13975500
          9.45221000          0.09683280          0.33936200
          3.66566000          0.61441800          0.45092100
          1.46746000          0.40379800          0.23858600
  1  0  1  3  1  1
          2.15623000         -0.25292300         -0.01776530
          0.74899700          0.03285170          0.27405800
          0.28314500          1.08125000          0.78542100
  1  0  1  1  1  1
          0.09983170          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (16s,10p) -> [4s,3p]
# SULFUR      (1d)
S  6-31Gxx 6-31G**
  5
  1  0  0  6  1
      21917.10000000          0.00186900
       3301.49000000          0.01423000
        754.14600000          0.06969600
        212.71100000          0.23848700
         67.98960000          0.48330700
         23.05150000          0.33807400
  1  0  1  6  1  1
        423.73500000         -0.00237670          0.00406100
        100.71000000         -0.03169300          0.03068100
         32.15990000         -0.11331700          0.13045200
         11.80790000          0.05609000          0.32720500
          4.63110000          0.59225500          0.45285100
          1.87025000          0.45500600          0.25604200
  1  0  1  3  1  1
          2.61584000         -0.25037400         -0.01451100
          0.92216700          0.06695700          0.31026300
          0.34128700          1.05451000          0.75448300
  1  0  1  1  1  1
          0.11716700          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (16s,10p) -> [4s,3p]
# CHLORINE    (1d)
CL 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      25180.10000000          0.00183300
       3780.35000000          0.01403400
        860.47400000          0.06909700
        242.14500000          0.23745200
         77.33490000          0.48303400
         26.24700000          0.33985600
  1  0  1  6  1  1
        491.76500000         -0.00229740          0.00398940
        116.98400000         -0.03071400          0.03031800
         37.41530000         -0.11252800          0.12988000
         13.78340000          0.04501600          0.32795100
          5.45215000          0.58935300          0.45352700
          2.22588000          0.46520600          0.25215400
  1  0  1  3  1  1
          3.18649000         -0.25183000         -0.01429900
          1.14427000          0.06158900          0.32357200
          0.42037700          1.06018000          0.74350700
  1  0  1  1  1  1
          0.14265700          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (16s,10p) -> [4s,3p]
# ARGON       (1d)
AR 6-31Gxx 6-31G**
  5
  1  0  0  6  1
      28348.30000000          0.00182526
       4257.62000000          0.01396860
        969.85700000          0.06870730
        273.26300000          0.23620400
         87.36950000          0.48221400
         29.68670000          0.34204300
  1  0  1  6  1  1
        575.89100000         -0.00215972          0.00380665
        136.81600000         -0.02907750          0.02923050
         43.80980000         -0.11082700          0.12646700
         16.20940000          0.02769990          0.32351000
          6.46084000          0.57761300          0.45489600
          2.65114000          0.48868800          0.25663000
  1  0  1  3  1  1
          3.86028000         -0.25559200         -0.01591970
          1.41373000          0.03780660          0.32464600
          0.51664600          1.08056000          0.74399000
  1  0  1  1  1  1
          0.17388800          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# POTASSIUM   (22s,16p) -> [5s,4p]
# POTASSIUM   (1d)
K  6-31Gxx 6-31G**
  6
  1  0  0  6  1
      31594.42000000          0.00182801
       4744.33000000          0.01399403
       1080.41900000          0.06887129
        304.23380000          0.23697600
         97.24586000          0.48290400
         33.02495000          0.34047950
  1  0  1  6  1  1
        622.76250000         -0.00250298          0.00409464
        147.88390000         -0.03315550          0.03145199
         47.32735000         -0.12263870          0.13515580
         17.51495000          0.05353643          0.33905000
          6.92272200          0.61938600          0.46294550
          2.76827700          0.43458780          0.22426380
  1  0  1  6  1  1
         11.84802000          0.01277689         -0.01221377
          4.07921100          0.20987670         -0.00690054
          1.76348100         -0.00309527          0.20074660
          0.78892700         -0.55938840          0.42813320
          0.35038700         -0.51347600          0.39701560
          0.14634400         -0.06598035          0.11047180
  1  0  1  3  1  1
          0.71680100         -0.05237772          0.03164300
          0.23374100         -0.27985030         -0.04046160
          0.03867500          1.14154700          1.01202900
  1  0  1  1  1  1
          0.01652100          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# CALCIUM     (22s,16p) -> [5s,4p]
# CALCIUM     (1d)
CA 6-31Gxx 6-31G**
  6
  1  0  0  6  1
      35264.86000000          0.00181350
       5295.50300000          0.01388493
       1206.02000000          0.06836162
        339.68390000          0.23561880
        108.62640000          0.48206390
         36.92103000          0.34298190
  1  0  1  6  1  1
        706.30960000          0.00244823          0.00402037
        167.81870000          0.03241504          0.03100601
         53.82558000          0.12262190          0.13372790
         20.01638000         -0.04316965          0.33679830
          7.97027900         -0.61269950          0.46312810
          3.21205900         -0.44875400          0.22575320
  1  0  1  6  1  1
         14.19518000          0.01084500         -0.01289621
          4.88082800          0.20883330         -0.01025198
          2.16039000          0.03150338          0.19597810
          0.98789900         -0.55265180          0.43579330
          0.44951700         -0.54379970          0.39964520
          0.18738700         -0.06669342          0.09713636
  1  0  1  3  1  1
          1.03227100         -0.04439720         -0.42986210
          0.38117100         -0.32845630          0.00693583
          0.06513100          1.16301000          0.97059330
  1  0  1  1  1  1
          0.02601000          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# SCANDIUM    (22s,16p,4d) -> [5s,4p,2d]
# SCANDIUM    (1f)
SC 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      39088.98000000          0.00180326
       5869.79200000          0.01380769
       1336.91000000          0.06800396
        376.60310000          0.23470990
        120.46790000          0.48156900
         40.98032000          0.34456520
  1  0  1  6  1  1
        786.28520000          0.00245186          0.00403953
        186.88700000          0.03259579          0.03122570
         60.00935000          0.12382420          0.13498330
         22.25883000         -0.04359890          0.34247930
          8.88514900         -0.61771810          0.46231130
          3.60921100         -0.44328230          0.21775240
  1  0  1  6  1  1
         29.84355000         -0.00258630         -0.00609665
          9.54238300          0.07188424         -0.02628884
          4.05679000          0.25032600          0.05091001
          1.70470300         -0.29910030          0.37980970
          0.70623400         -0.74468180          0.51708830
          0.27953600         -0.17997760          0.18297720
  1  0  1  3  1  1
          1.06560900          0.06482978         -0.29384400
          0.42593300          0.32537560          0.09235323
          0.07632000         -1.17080600          0.98479300
  1  0  1  1  1  1
          0.02959400          1.00000000          1.00000000
  1  2  2  3  1
         11.14701000          0.08747672
          2.82104300          0.37956350
          0.81962000          0.71803930
  1  2  2  1  1
          0.22146800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# TITANIUM    (22s,16p,4d) -> [5s,4p,2d]
# TITANIUM    (1f)
TI 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      43152.95000000          0.00179187
       6479.57100000          0.01372392
       1475.67500000          0.06762830
        415.69910000          0.23376420
        133.00060000          0.48106960
         45.27222000          0.34622800
  1  0  1  6  1  1
        874.68260000          0.00243101          0.00401768
        207.97850000          0.03233027          0.03113966
         66.87918000          0.12425200          0.13490770
         24.87347000         -0.03903905          0.34316720
          9.96844100         -0.61717890          0.46257600
          4.06382600         -0.44730970          0.21546030
  1  0  1  6  1  1
         33.64363000         -0.00294036         -0.00631162
         10.87565000          0.07163103         -0.02697638
          4.62822500          0.25289150          0.05316847
          1.95012600         -0.29664010          0.38455490
          0.80945200         -0.74322150          0.51276620
          0.32047400         -0.18535200          0.18111350
  1  0  1  3  1  1
          1.22414800          0.06351465         -0.21120700
          0.48426300          0.31514040          0.07771998
          0.08409600         -1.16259500          0.98982140
  1  0  1  1  1  1
          0.03203600          1.00000000          1.00000000
  1  2  2  3  1
         13.69085000          0.08589418
          3.51315400          0.37846710
          1.04043400          0.71612390
  1  2  2  1  1
          0.28696200          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# VANADIUM    (22s,16p,4d) -> [5s,4p,2d]
# VANADIUM    (1f)
V  6-31Gxx 6-31G**
  8
  1  0  0  6  1
      47354.33000000          0.00178451
       7110.78700000          0.01366754
       1619.59100000          0.06736122
        456.33790000          0.23305520
        146.06060000          0.48063160
         49.75791000          0.34748020
  1  0  1  6  1  1
        968.14840000          0.00241060          0.00399500
        230.28210000          0.03207243          0.03104061
         74.14591000          0.12459420          0.13477470
         27.64107000         -0.03482177          0.34372790
         11.11475000         -0.61673740          0.46287590
          4.54311300         -0.45098440          0.21355470
  1  0  1  6  1  1
         37.64050000         -0.00323320         -0.00649406
         12.28238000          0.07130744         -0.02753453
          5.23336600          0.25438200          0.05516284
          2.20895000         -0.29338870          0.38796720
          0.91788000         -0.74156950          0.50902580
          0.36341200         -0.19094100          0.18038400
  1  0  1  3  1  1
          1.39278100          0.06139703         -0.18912650
          0.54391300          0.30611300          0.08005453
          0.09147600         -1.15489000          0.98773990
  1  0  1  1  1  1
          0.03431200          1.00000000          1.00000000
  1  2  2  3  1
         16.05025000          0.08599899
          4.16006300          0.38029960
          1.24326500          0.71276590
  1  2  2  1  1
          0.34427700          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# CHROMIUM    (22s,16p,4d) -> [5s,4p,2d]
# CHROMIUM    (1f)
CR 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      51789.81000000          0.00177618
       7776.84900000          0.01360476
       1771.38500000          0.06706925
        499.15880000          0.23231040
        159.79820000          0.48024100
         54.47021000          0.34876530
  1  0  1  6  1  1
       1064.32800000          0.00239967          0.00398700
        253.21380000          0.03194886          0.03104662
         81.60924000          0.12508680          0.13505180
         30.48193000         -0.03221866          0.34488650
         12.29439000         -0.61722840          0.46285710
          5.03772200         -0.45259360          0.21104260
  1  0  1  6  1  1
         41.56291000         -0.00345422         -0.00672250
         13.67627000          0.07218428         -0.02806471
          5.84439000          0.25448200          0.05820028
          2.47160900         -0.29345340          0.39169880
          1.02830800         -0.73854550          0.50478230
          0.40725000         -0.19471570          0.17902900
  1  0  1  3  1  1
          1.57146400          0.05892219         -0.19301000
          0.60558000          0.29760550          0.09605620
          0.09856100         -1.14750600          0.98176090
  1  0  1  1  1  1
          0.03645900          1.00000000          1.00000000
  1  2  2  3  1
         18.41930000          0.08650816
          4.81266100          0.38266990
          1.44644700          0.70937720
  1  2  2  1  1
          0.40041300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# MANGANESE   (22s,16p,4d) -> [5s,4p,2d]
# MANGANESE   (1f)
MN 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      56347.14000000          0.00177158
       8460.94300000          0.01357081
       1927.32500000          0.06690605
        543.23430000          0.23185410
        173.99050000          0.47990460
         59.36005000          0.34957370
  1  0  1  6  1  1
       1165.41200000          0.00238875          0.00397732
        277.32760000          0.03181708          0.03103112
         89.47278000          0.12546700          0.13518940
         33.48256000         -0.02955431          0.34573870
         13.54037000         -0.61751600          0.46292050
          5.55797200         -0.45444580          0.20905920
  1  0  1  6  1  1
         45.83532000         -0.00366586         -0.00688758
         15.18777000          0.07231971         -0.02846816
          6.50071000          0.25444860          0.06031832
          2.75158300         -0.29103800          0.39389610
          1.14540400         -0.73598600          0.50137690
          0.45368700         -0.19976170          0.17922640
  1  0  1  3  1  1
          1.75799900          0.05628572         -0.50350240
          0.66702200          0.28974910          0.23450110
          0.10512900         -1.14065300          0.91412570
  1  0  1  1  1  1
          0.03841800          1.00000000          1.00000000
  1  2  2  3  1
         20.94355000          0.08672702
          5.51048600          0.38418830
          1.66503800          0.70690710
  1  2  2  1  1
          0.46173300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# IRON        (22s,16p,4d) -> [5s,4p,2d]
# IRON        (1f)
FE 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      61132.62000000          0.00176611
       9179.34200000          0.01353038
       2090.85700000          0.06673128
        589.24790000          0.23148230
        188.75430000          0.47970580
         64.44629000          0.35019760
  1  0  1  6  1  1
       1259.98000000          0.00243801          0.00402802
        299.87610000          0.03224048          0.03144647
         96.84917000          0.12657240          0.13683170
         36.31020000         -0.03139902          0.34872360
         14.72996000         -0.62075930          0.46179310
          6.06607500         -0.45029140          0.20430580
  1  0  1  6  1  1
         50.43485000         -0.00387326         -0.00701713
         16.83929000          0.07196598         -0.02877660
          7.19208600          0.25565910          0.06181383
          3.05342000         -0.28828370          0.39549460
          1.27364300         -0.73428220          0.49890590
          0.50409100         -0.20493530          0.17912510
  1  0  1  3  1  1
          1.95031600          0.05694869         -0.45937960
          0.73672100          0.28829150          0.28521390
          0.11417700         -1.13815900          0.90764850
  1  0  1  1  1  1
          0.04114800          1.00000000          1.00000000
  1  2  2  3  1
         23.14994000          0.08876935
          6.12236800          0.38963190
          1.84660100          0.70148160
  1  2  2  1  1
          0.50436100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COBALT      (22s,16p,4d) -> [5s,4p,2d]
# COBALT      (1f)
CO 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      66148.99000000          0.00175979
       9933.07700000          0.01348162
       2262.81600000          0.06649342
        637.91540000          0.23079390
        204.41220000          0.47929190
         69.82538000          0.35140970
  1  0  1  6  1  1
       1378.84100000          0.00237628          0.00397149
        328.26940000          0.03167450          0.03108174
        106.09460000          0.12628880          0.13574390
         39.83275000         -0.02584552          0.34768270
         16.18622000         -0.61834910          0.46263400
          6.66778800         -0.45670080          0.20516320
  1  0  1  6  1  1
         54.52355000         -0.00399300         -0.00729077
         18.29783000          0.07409663         -0.02926027
          7.86734800          0.25420000          0.06564150
          3.34053400         -0.29216570          0.40006520
          1.39375600         -0.73187030          0.49502360
          0.55132600         -0.20407840          0.17582400
  1  0  1  3  1  1
          2.15194700          0.05379843         -0.21654960
          0.81106300          0.27599710          0.12404880
          0.12101700         -1.12969200          0.97240640
  1  0  1  1  1  1
          0.04303700          1.00000000          1.00000000
  1  2  2  3  1
         25.59306000          0.09004748
          6.80099000          0.39317030
          2.05164700          0.69768440
  1  2  2  1  1
          0.55567100          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# NICKEL      (22s,16p,4d) -> [5s,4p,2d]
# NICKEL      (1f)
NI 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      71396.35000000          0.00175300
      10720.84000000          0.01343122
       2442.12900000          0.06627041
        688.42650000          0.23025080
        220.61530000          0.47901860
         75.39373000          0.35234440
  1  0  1  6  1  1
       1492.53200000          0.00237071          0.00396755
        355.40130000          0.03160566          0.03109479
        114.95340000          0.12663350          0.13595170
         43.22043000         -0.02417037          0.34851360
         17.59710000         -0.61877750          0.46254980
          7.25776500         -0.45767700          0.20351860
  1  0  1  6  1  1
         59.35261000         -0.00416200         -0.00742145
         20.02181000          0.07425111         -0.02953410
          8.61456100          0.25413600          0.06731852
          3.66053100         -0.29034770          0.40166600
          1.52811100         -0.73021210          0.49266230
          0.60405700         -0.20760570          0.17568930
  1  0  1  3  1  1
          2.37927600          0.05157888         -0.18876630
          0.88583900          0.27076110          0.10151990
          0.12852900         -1.12477000          0.97909060
  1  0  1  1  1  1
          0.04519500          1.00000000          1.00000000
  1  2  2  3  1
         28.19147000          0.09098881
          7.52358400          0.39582080
          2.27122800          0.69471540
  1  2  2  1  1
          0.61160300          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# COPPER      (22s,16p,4d) -> [5s,4p,2d]
# COPPER      (1f)
CU 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      76794.38000000          0.00174816
      11530.70000000          0.01339602
       2626.57500000          0.06610885
        740.49030000          0.22982650
        237.35280000          0.47876750
         81.15818000          0.35307390
  1  0  1  6  1  1
       1610.81400000          0.00236405          0.00396331
        383.63670000          0.03153635          0.03110223
        124.17330000          0.12694520          0.13613500
         46.74678000         -0.02262840          0.34929140
         19.06569000         -0.61920800          0.46247800
          7.87156700         -0.45853930          0.20201020
  1  0  1  6  1  1
         64.45732000         -0.00433108         -0.00752373
         21.85212000          0.07412307         -0.02975687
          9.40534300          0.25421080          0.06849654
          3.99916800         -0.28748430          0.40271410
          1.67029700         -0.72914360          0.49084900
          0.65962700         -0.21139510          0.17592680
  1  0  1  3  1  1
          2.60008800          0.05027577         -0.17029110
          0.96309400          0.26500400          0.09310133
          0.13616100         -1.12015500          0.98143360
  1  0  1  1  1  1
          0.04733200          1.00000000          1.00000000
  1  2  2  3  1
         30.85341000          0.09199905
          8.26498500          0.39850210
          2.49533200          0.69178970
  1  2  2  1  1
          0.66765800          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# ZINC        (22s,16p,4d) -> [5s,4p,2d]
# ZINC        (1f)
ZN 6-31Gxx 6-31G**
  8
  1  0  0  6  1
      82400.94000000          0.00174333
      12372.55000000          0.01335966
       2818.35100000          0.06594365
        794.57170000          0.22941510
        254.72320000          0.47854530
         87.13880000          0.35377530
  1  0  1  6  1  1
       1732.56900000          0.00236146          0.00396313
        412.71490000          0.03150177          0.03113411
        133.67800000          0.12727740          0.13639310
         50.38585000         -0.02145928          0.35012660
         20.58358000         -0.61976520          0.46231790
          8.50594000         -0.45901800          0.20049950
  1  0  1  6  1  1
         69.36492000         -0.00444010         -0.00768926
         23.62082000          0.07505253         -0.02997982
         10.18471000          0.25331110          0.07082411
          4.33408200         -0.28818970          0.40461410
          1.81091800         -0.72670520          0.48823250
          0.71484100         -0.21334390          0.17519700
  1  0  1  3  1  1
          2.82384200          0.04898543         -0.15867630
          1.03954300          0.25927930          0.08379327
          0.14326400         -1.11571100          0.98405470
  1  0  1  1  1  1
          0.04929600          1.00000000          1.00000000
  1  2  2  3  1
         33.70764000          0.09262648
          9.06110600          0.40029800
          2.73838300          0.68966080
  1  2  2  1  1
          0.73029400          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# BASIS="6-31++G**"
#Elements                             References
#--------                             ----------
# H - He: W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys. 56,
#Li - Ne: 2257 (1972).  Note: Li and B come from J.D. Dill and J.A.
#         Pople, J. Chem. Phys. 62, 2921 (1975).
#Na - Ar: M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon,
#         D.J. DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982)
#K  - Zn: V. Rassolov, J.A. Pople, M. Ratner and T.L. Windus, J. Chem. Phys.
#         109, 1223 (1998)
#**
#         Note: He and Ne are unpublished basis sets taken from the Gaussian
#         program
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#Elements                             References
#--------                             ----------
#H,Li - Ne: P.C. Hariharan and J.A. Pople, Theoret. Chimica Acta 28, 213 (1973).
#
#Na - Ar  : M.M. Francl, W.J. Petro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J.
#
#           DeFrees and J.A. Pople, J. Chem. Phys. 77, 3654 (1982).
#K  - Zn:   V.A. Rassolov, J.A. Pople, M.A. Ratner, and T.L. Windus
#           J. Chem. Phys. 109, 1223 (1998)
#           Note: He and Ne are unpublished basis sets taken from Gaussian.
#
# HYDROGEN    (4s) -> [2s]
# HYDROGEN    (Diffuse s)
# HYDROGEN    (1p)
H  6-31++Gxx 6-31++G**
  4
  1  0  0  3  1
         18.73113700          0.03349460
          2.82539370          0.23472695
          0.64012170          0.81375733
  1  0  0  1  1
          0.16127780          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# HELIUM      (4s) -> [2s]
# HELIUM      (1p)
HE 6-31++Gxx 6-31++G**
  3
  1  0  0  3  1
         38.42163400          0.02376600
          5.77803000          0.15467900
          1.24177400          0.46963000
  1  0  0  1  1
          0.29796400          1.00000000
  1  1  1  1  1
          1.10000000          1.00000000
# LITHIUM     (10s,4p) -> [3s,2p]
# LITHIUM     (1d)
LI 6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
        642.41892000          0.00214260
         96.79851500          0.01620890
         22.09112100          0.07731560
          6.20107030          0.24578600
          1.93511770          0.47018900
          0.63673580          0.34547080
  1  0  1  3  1  1
          2.32491840         -0.03509170          0.00894150
          0.63243060         -0.19123280          0.14100950
          0.07905340          1.08398780          0.94536370
  1  0  1  1  1  1
          0.03596200          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0074000           1.0000000           1.0000000        
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (10s,4p) -> [3s,2p]
# BERYLLIUM   (1d)
BE 6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       1264.58570000          0.00194480
        189.93681000          0.01483510
         43.15908900          0.07209060
         12.09866300          0.23715420
          3.80632320          0.46919870
          1.27289030          0.35652020
  1  0  1  3  1  1
          3.19646310         -0.11264870          0.05598020
          0.74781330         -0.22950640          0.26155060
          0.21996630          1.18691670          0.79397230
  1  0  1  1  1  1
          0.08230990          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0207000           1.0000000           1.0000000
  1  2  2  1  1
          0.40000000          1.00000000
# BORON       (10s,4p) -> [3s,2p]
# BORON       (1d)
B  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       2068.88230000          0.00186630
        310.64957000          0.01425150
         70.68303300          0.06955160
         19.86108000          0.23257290
          6.29930480          0.46707870
          2.12702700          0.36343140
  1  0  1  3  1  1
          4.72797100         -0.13039380          0.07459760
          1.19033770         -0.13078890          0.30784670
          0.35941170          1.13094440          0.74345680
  1  0  1  1  1  1
          0.12675120          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0315000           1.0000000           1.0000000 
  1  2  2  1  1
          0.60000000          1.00000000
# CARBON      (10s,4p) -> [3s,2p]
C  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       3047.52490000          0.00183470
        457.36951000          0.01403730
        103.94869000          0.06884260
         29.21015500          0.23218440
          9.28666300          0.46794130
          3.16392700          0.36231200
  1  0  1  3  1  1
          7.86827240         -0.11933240          0.06899910
          1.88128850         -0.16085420          0.31642400
          0.54424930          1.14345640          0.74430830
  1  0  1  1  1  1
          0.16871440          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0438000           1.0000000           1.0000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (10s,4p) -> [3s,2p]
N  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       4173.51100000          0.00183480
        627.45790000          0.01399500
        142.90210000          0.06858700
         40.23433000          0.23224100
         12.82021000          0.46907000
          4.39043700          0.36045500
  1  0  1  3  1  1
         11.62635800         -0.11496100          0.06758000
          2.71628000         -0.16911800          0.32390700
          0.77221800          1.14585200          0.74089500
  1  0  1  1  1  1
          0.21203130          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0639000           1.0000000           1.0000000
  1  2  2  1  1
          0.80000000          1.00000000
# OXYGEN      (10s,4p) -> [3s,2p]
O  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       5484.67170000          0.00183110
        825.23495000          0.01395010
        188.04696000          0.06844510
         52.96450000          0.23271430
         16.89757000          0.47019300
          5.79963530          0.35852090
  1  0  1  3  1  1
         15.53961600         -0.11077750          0.07087430
          3.59993360         -0.14802630          0.33975280
          1.01376180          1.13076700          0.72715860
  1  0  1  1  1  1
          0.27000580          1.00000000          1.00000000
  1  0  1  1  1  1
          0.0845000           1.0000000           1.0000000
  1  2  2  1  1
          0.80000000          1.00000000
# FLUORINE    (10s,4p) -> [3s,2p]
F  6-31++Gxx 6-31++G**
  5
  1  0  0  6  1
       7001.71309000          0.00181962
       1051.36609000          0.01391608
        239.28569000          0.06840532
         67.39744530          0.23318576
         21.51995730          0.47126744
          7.40310130          0.35661855
  1  0  1  3  1  1
         20.84795280         -0.10850698          0.07162872
          4.80830834         -0.14645166          0.34591210
          1.34406986          1.12868858          0.72246996
  1  0  1  1  1  1
          0.35815139          1.00000000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NEON        (10s,4p) -> [3s,2p]
# NEON        (1d)
NE 6-31++Gxx 6-31++G**
  4
  1  0  0  6  1
       8425.85153000          0.00188435
       1268.51940000          0.01433690
        289.62141400          0.07010962
         81.85900400          0.23737327
         26.25150790          0.47300713
          9.09472051          0.34840124
  1  0  1  3  1  1
         26.53213100         -0.10711829          0.07190959
          6.10175501         -0.14616382          0.34951337
          1.69627153          1.12777350          0.71994051
  1  0  1  1  1  1
          0.44581870          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# SODIUM      (16s,10p) -> [4s,3p]
# SODIUM      (1d)
NA 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
       9993.20000000          0.00193770
       1499.89000000          0.01480700
        341.95100000          0.07270600
         94.67970000          0.25262900
         29.73450000          0.49324200
         10.00630000          0.31316900
  1  0  1  6  1  1
        150.96300000         -0.00354210          0.00500170
         35.58780000         -0.04395900          0.03551100
         11.16830000         -0.10975210          0.14282500
          3.90201000          0.18739800          0.33862000
          1.38177000          0.64669900          0.45157900
          0.46638200          0.30605800          0.27327100
  1  0  1  3  1  1
          0.49796600         -0.24850300         -0.02302300
          0.08435300         -0.13170400          0.95035900
          0.06663500          1.23352000          0.05985800
  1  0  1  1  1  1
          0.02595440          1.00000000          1.00000000
  1  0  1  1  1  1
          0.00760000          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (16s,10p) -> [4s,3p]
# MAGNESIUM   (1d)
MG 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      11722.80000000          0.00197780
       1759.93000000          0.01511400
        400.84600000          0.07391100
        112.80700000          0.24919100
         35.99970000          0.48792800
         12.18280000          0.31966200
  1  0  1  6  1  1
        189.18000000         -0.00323720          0.00492810
         45.21190000         -0.04100800          0.03498900
         14.35630000         -0.11260000          0.14072500
          5.13886000          0.14863300          0.33364200
          1.90652000          0.61649700          0.44494000
          0.70588700          0.36482900          0.26925400
  1  0  1  3  1  1
          0.92934000         -0.21229000         -0.02241900
          0.26903500         -0.10798500          0.19227000
          0.11737900          1.17584000          0.84618100
  1  0  1  1  1  1
          0.04210610          1.00000000          1.00000000
  1  0  1  1  1  1
          0.01460000          1.00000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (16s,10p) -> [4s,3p]
# ALUMINUM    (1d)
AL 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      13983.10000000          0.00194267
       2098.75000000          0.01485990
        477.70500000          0.07284940
        134.36000000          0.24683000
         42.87090000          0.48725800
         14.51890000          0.32349600
  1  0  1  6  1  1
        239.66800000         -0.00292619          0.00460285
         57.44190000         -0.03740800          0.03319900
         18.28590000         -0.11448700          0.13628200
          6.59914000          0.11563500          0.33047600
          2.49049000          0.61259500          0.44914600
          0.94454000          0.39379900          0.26570400
  1  0  1  3  1  1
          1.27790000         -0.22760600         -0.01751300
          0.39759000          0.00144583          0.24453300
          0.16009500          1.09279000          0.80493400
  1  0  1  1  1  1
          0.05565770          1.00000000          1.00000000
  1  0  1  1  1  1
          0.03180000          1.00000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (16s,10p) -> [4s,3p]
# SILICON     (1d)
SI 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      16115.90000000          0.00195948
       2425.58000000          0.01492880
        553.86700000          0.07284780
        156.34000000          0.24613000
         50.06830000          0.48591400
         17.01780000          0.32500200
  1  0  1  6  1  1
        292.71800000         -0.00278094          0.00443826
         69.87310000         -0.03571460          0.03266790
         22.33630000         -0.11498500          0.13472100
          8.15039000          0.09356340          0.32867800
          3.13458000          0.60301700          0.44964000
          1.22543000          0.41895900          0.26137200
  1  0  1  3  1  1
          1.72738000         -0.24463000         -0.01779510
          0.57292200          0.00431572          0.25353900
          0.22219200          1.09818000          0.80066900
  1  0  1  1  1  1
          0.07783690          1.00000000          1.00000000
  1  0  1  1  1  1
          0.03310000          1.00000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (16s,10p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      19413.30000000          0.00185160
       2909.42000000          0.01420620
        661.36400000          0.06999950
        185.75900000          0.24007900
         59.19430000          0.48476200
         20.03100000          0.33520000
  1  0  1  6  1  1
        339.47800000         -0.00278217          0.00456462
         81.01010000         -0.03604990          0.03369360
         25.87800000         -0.11663100          0.13975500
          9.45221000          0.09683280          0.33936200
          3.66566000          0.61441800          0.45092100
          1.46746000          0.40379800          0.23858600
  1  0  1  3  1  1
          2.15623000         -0.25292300         -0.01776530
          0.74899700          0.03285170          0.27405800
          0.28314500          1.08125000          0.78542100
  1  0  1  1  1  1
          0.09983170          1.00000000          1.00000000
  1  0  1  1  1  1
          0.03480000          1.00000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (16s,10p) -> [4s,3p]
# SULFUR      (1d)
S  6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      21917.10000000          0.00186900
       3301.49000000          0.01423000
        754.14600000          0.06969600
        212.71100000          0.23848700
         67.98960000          0.48330700
         23.05150000          0.33807400
  1  0  1  6  1  1
        423.73500000         -0.00237670          0.00406100
        100.71000000         -0.03169300          0.03068100
         32.15990000         -0.11331700          0.13045200
         11.80790000          0.05609000          0.32720500
          4.63110000          0.59225500          0.45285100
          1.87025000          0.45500600          0.25604200
  1  0  1  3  1  1
          2.61584000         -0.25037400         -0.01451100
          0.92216700          0.06695700          0.31026300
          0.34128700          1.05451000          0.75448300
  1  0  1  1  1  1
          0.11716700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.04050000          1.00000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (16s,10p) -> [4s,3p]
# CHLORINE    (1d)
CL 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      25180.10000000          0.00183300
       3780.35000000          0.01403400
        860.47400000          0.06909700
        242.14500000          0.23745200
         77.33490000          0.48303400
         26.24700000          0.33985600
  1  0  1  6  1  1
        491.76500000         -0.00229740          0.00398940
        116.98400000         -0.03071400          0.03031800
         37.41530000         -0.11252800          0.12988000
         13.78340000          0.04501600          0.32795100
          5.45215000          0.58935300          0.45352700
          2.22588000          0.46520600          0.25215400
  1  0  1  3  1  1
          3.18649000         -0.25183000         -0.01429900
          1.14427000          0.06158900          0.32357200
          0.42037700          1.06018000          0.74350700
  1  0  1  1  1  1
          0.14265700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.04830000          1.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (16s,10p) -> [4s,3p]
AR 6-31++Gxx 6-31++G**
  6
  1  0  0  6  1
      28348.30000000          0.00182526
       4257.62000000          0.01396860
        969.85700000          0.06870730
        273.26300000          0.23620400
         87.36950000          0.48221400
         29.68670000          0.34204300
  1  0  1  6  1  1
        575.89100000         -0.00215972          0.00380665
        136.81600000         -0.02907750          0.02923050
         43.80980000         -0.11082700          0.12646700
         16.20940000          0.02769990          0.32351000
          6.46084000          0.57761300          0.45489600
          2.65114000          0.48868800          0.25663000
  1  0  1  3  1  1
          3.86028000         -0.25559200         -0.01591970
          1.41373000          0.03780660          0.32464600
          0.51664600          1.08056000          0.74399000
  1  0  1  1  1  1
          0.17388800          1.00000000          1.00000000
  1  0  1  1  1  1
          0.06000000          1.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# BASIS="6-311G**"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H - Ar:  R. Krishnan, J.S. Binkley, R. Seeger, J.A. Pople, J. Chem. Phys. 72,
#         650 (1980)
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (1p)
H  6-311Gxx 6-311G**
  4
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (1p)
HE 6-311Gxx 6-311G**
  4
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (1d)
LI 6-311Gxx 6-311G**
  5
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (1d)
BE 6-311Gxx 6-311G**
  5
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.25500000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (1d)
B  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.40100000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (1d)
C  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          0.62600000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (1d)
N  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          0.91300000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (1d)
O  6-311Gxx 6-311G**
  5
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          1.29200000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (1d)
F  6-311Gxx 6-311G**
  5
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (1d)
NE 6-311Gxx 6-311G**
  5
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          2.30400000          1.00000000
# SODIUM      (12s,9p) -> [6s,5p]
# SODIUM      (1d)
NA 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212900          0.00000000
        339.62300000          0.16978900          0.00000000
        109.55300000          0.51462100          0.00000000
         38.77730000          0.37981700          0.37476200
         14.57590000          0.00000000          0.57576900
          5.26993000          0.00000000          0.11293300
  1  0  0  1  1
          1.82777000          1.00000000
  1  0  0  1  1
          0.61994800          1.00000000
  1  0  0  1  1
          0.05724000          1.00000000
  1  0  0  1  1
          0.02404800          1.00000000
  1  1  1  4  1
        144.64500000          0.01148500
         33.90740000          0.08238300
         10.62850000          0.31965800
          3.82389000          0.70129500
  1  1  1  2  1
          1.44429000          0.63850600
          0.55262100          0.42536500
  1  1  1  1  1
          0.18872000          1.00000000
  1  1  1  1  1
          0.04650100          1.00000000
  1  1  1  1  1
          0.01628500          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# MAGNESIUM   (12s,9p) -> [6s,5p]
# MAGNESIUM   (1d)
MG 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      43866.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676400          0.00000000
         51.39830000          0.49797500          0.25135500
         19.91960000          0.00000000          0.61867100
          8.02474000          0.00000000          0.18841700
  1  0  0  1  1
          2.50817000          1.00000000
  1  0  0  1  1
          0.87153100          1.00000000
  1  0  0  1  1
          0.10818800          1.00000000
  1  0  0  1  1
          0.04013000          1.00000000
  1  1  1  4  1
        193.85400000          0.01018800
         45.44200000          0.07536000
         14.18640000          0.30741900
          5.05751000          0.71757500
  1  1  1  2  1
          1.88861000          0.66733900
          0.72265200          0.39464900
  1  1  1  1  1
          0.23641700          1.00000000
  1  1  1  1  1
          0.09335800          1.00000000
  1  1  1  1  1
          0.03480900          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
# ALUMINUM    (12s,9p) -> [6s,5p]
# ALUMINUM    (1d)
AL 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      54866.48900000          0.00083900          0.00000000
       8211.76650000          0.00652700          0.00000000
       1866.17610000          0.03366600          0.00000000
        531.12934000          0.13290200          0.00000000
        175.11797000          0.40126600          0.00000000
         64.00550000          0.53133800          0.20230500
         25.29250700          0.00000000          0.62479000
         10.53491000          0.00000000          0.22743900
  1  0  0  1  1
          3.20671100          1.00000000
  1  0  0  1  1
          1.15255500          1.00000000
  1  0  0  1  1
          0.17667800          1.00000000
  1  0  0  1  1
          0.06523700          1.00000000
  1  1  1  4  1
        259.28362000          0.00944800
         61.07687000          0.07097400
         19.30323700          0.29563600
          7.01088200          0.72821900
  1  1  1  2  1
          2.67386500          0.64446700
          1.03659600          0.41741300
  1  1  1  1  1
          0.31681900          1.00000000
  1  1  1  1  1
          0.11425700          1.00000000
  1  1  1  1  1
          0.04139700          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
# SILICON     (12s,9p) -> [6s,5p]
# SILICON     (1d)
SI 6-311Gxx 6-311G**
 11
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.87960000          0.03108800          0.00000000
        657.14295000          0.12496700          0.00000000
        214.30113000          0.38689700          0.00000000
         77.62916800          0.55488800          0.17788100
         30.63080700          0.00000000          0.62776500
         12.80129500          0.00000000          0.24762300
  1  0  0  1  1
          3.92686600          1.00000000
  1  0  0  1  1
          1.45234300          1.00000000
  1  0  0  1  1
          0.25623400          1.00000000
  1  0  0  1  1
          0.09427900          1.00000000
  1  1  1  4  1
        335.48319000          0.00886600
         78.90036600          0.06829900
         24.98815000          0.29095800
          9.21971100          0.73211700
  1  1  1  2  1
          3.62114000          0.61987900
          1.45131000          0.43914800
  1  1  1  1  1
          0.50497700          1.00000000
  1  1  1  1  1
          0.18631700          1.00000000
  1  1  1  1  1
          0.06543200          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHORUS  (12s,9p) -> [6s,5p]
# PHOSPHORUS  (1d)
P  6-311Gxx 6-311G**
 11
  1  0  0  8  2
      77492.40000000          0.00078100          0.00000000
      11605.80000000          0.00606800          0.00000000
       2645.96000000          0.03116000          0.00000000
        754.97600000          0.12343100          0.00000000
        248.75500000          0.37820900          0.00000000
         91.15650000          0.56326200          0.16025500
         36.22570000          0.00000000          0.62764700
         15.21130000          0.00000000          0.26384900
  1  0  0  1  1
          4.79417000          1.00000000
  1  0  0  1  1
          1.80793000          1.00000000
  1  0  0  1  1
          0.35681600          1.00000000
  1  0  0  1  1
          0.11478300          1.00000000
  1  1  1  4  1
        384.84300000          0.00920600
         90.55210000          0.06987400
         29.13390000          0.29247000
         10.88620000          0.72810300
  1  1  1  2  1
          4.35259000          0.62834900
          1.77706000          0.42804400
  1  1  1  1  1
          0.69700500          1.00000000
  1  1  1  1  1
          0.25353200          1.00000000
  1  1  1  1  1
          0.06849300          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# SULFUR      (12s,9p) -> [6s,5p]
# SULFUR      (1d)
S  6-311Gxx 6-311G**
 11
  1  0  0  8  2
      93413.40000000          0.00074300          0.00000000
      13961.70000000          0.00579300          0.00000000
       3169.91000000          0.02995400          0.00000000
        902.45600000          0.11902800          0.00000000
        297.15800000          0.36843200          0.00000000
        108.70200000          0.57729900          0.14318600
         43.15530000          0.00000000          0.62446500
         18.10790000          0.00000000          0.28336600
  1  0  0  1  1
          5.56009000          1.00000000
  1  0  0  1  1
          2.13183000          1.00000000
  1  0  0  1  1
          0.42040300          1.00000000
  1  0  0  1  1
          0.13604500          1.00000000
  1  1  1  4  1
        495.04000000          0.00830900
        117.22100000          0.06402400
         37.77490000          0.27761400
         14.05840000          0.74507600
  1  1  1  2  1
          5.56574000          0.61371200
          2.26297000          0.44381800
  1  1  1  1  1
          0.80799400          1.00000000
  1  1  1  1  1
          0.27746000          1.00000000
  1  1  1  1  1
          0.07714100          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# CHLORINE    (12s,9p) -> [6s,5p]
# CHLORINE    (1d)
CL 6-311Gxx 6-311G**
 10
  1  0  0  8  2
     105819.00000000          0.00073800          0.00000000
      15872.00000000          0.00571800          0.00000000
       3619.65000000          0.02949500          0.00000000
       1030.80000000          0.11728600          0.00000000
        339.90800000          0.36294900          0.00000000
        124.53800000          0.58414900          0.13417700
         49.51350000          0.00000000          0.62425000
         20.80560000          0.00000000          0.29175600
  1  0  0  1  1
          6.58346000          1.00000000
  1  0  0  1  1
          2.56468000          1.00000000
  1  0  0  1  1
          0.55976300          1.00000000
  1  0  0  1  1
          0.18327300          1.00000000
  1  1  1  6  2
        589.77600000          0.00239100          0.00000000
        139.84900000          0.01850400          0.00000000
         45.14130000          0.08137700          0.00000000
         16.87330000          0.22155200          0.00000000
          6.74110000          0.77256900         -1.57224400
          2.77152000          0.00000000          0.99238900
  1  1  1  1  1
          1.02387000          1.00000000
  1  1  1  1  1
          0.38136800          1.00000000
  1  1  1  1  1
          0.10943700          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
# ARGON       (12s,9p) -> [6s,5p]
# ARGON       (1d)
AR 6-311Gxx 6-311G**
 10
  1  0  0  8  2
     118022.38000000          0.00074700          0.00000000
      17683.54100000          0.00579000          0.00000000
       4027.76570000          0.02991900          0.00000000
       1145.39770000          0.11920600          0.00000000
        377.16375000          0.36902800          0.00000000
        138.15969000          0.57645900          0.14392700
         54.98911700          0.00000000          0.62293800
         23.17066700          0.00000000          0.28396400
  1  0  0  1  1
          7.37786000          1.00000000
  1  0  0  1  1
          2.92368800          1.00000000
  1  0  0  1  1
          0.65040500          1.00000000
  1  0  0  1  1
          0.23282500          1.00000000
  1  1  1  6  2
        663.06201000          0.00308200          0.00000000
        157.09281000          0.02416500          0.00000000
         50.23110000          0.10822300          0.00000000
         18.63534500          0.29419200          0.00000000
          7.44653700          0.68786200         -0.12144820
          3.09569800          0.00000000          0.16323700
  1  1  1  1  1
          1.10646300          1.00000000
  1  1  1  1  1
          0.41560100          1.00000000
  1  1  1  1  1
          0.14544900          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
# POTASSIUM   (14s,11p,3d) -> [8s,7p,1d]
# POTASSIUM   (1d)
K  6-311Gxx 6-311G**
 17
  1  0  0  6  1
     182594.00000000          0.00022775
      27369.00000000          0.00176640
       6229.17000000          0.00919497
       1764.58000000          0.03745510
        577.05100000          0.12204500
        210.24900000          0.29899000
  1  0  0  2  1
         82.61780000          0.40514700
         33.23320000          0.29253200
  1  0  0  1  1
          8.10649000          1.00000000
  1  0  0  1  1
          3.33403000          1.00000000
  1  0  0  1  1
          0.84554400          1.00000000
  1  0  0  1  1
          0.32821600          1.00000000
  1  0  0  1  1
          0.03640350          1.00000000
  1  0  0  1  1
          0.01764630          1.00000000
  1  1  1  3  1
        891.05400000          0.00218429
        211.01600000          0.01758910
         67.67140000          0.08177750
  1  1  1  3  1
         25.27150000          0.24565600
         10.13900000          0.43398400
          4.20186000          0.36237700
  1  1  1  1  1
          1.62507000          1.00000000
  1  1  1  1  1
          0.64377000          1.00000000
  1  1  1  1  1
          0.24613000          1.00000000
  1  1  1  1  1
          0.04544000          1.00000000
  1  1  1  1  1
          0.01616000          1.00000000
  1  2  2  3  1
         13.37000000          0.03160160
          3.42100000          0.15687900
          1.06300000          0.39058200
  1  2  2  1  1
          0.22900000          1.00000000
# CALCIUM     (14s,11p,3d) -> [8s,7p,1d]
# CALCIUM     (1d)
CA 6-311Gxx 6-311G**
 17
  1  0  0  6  1
     202699.00000000          0.00022296
      30382.50000000          0.00172932
       6915.08000000          0.00900226
       1959.02000000          0.03666990
        640.93600000          0.11941000
        233.97700000          0.29182500
  1  0  0  2  1
         92.28920000          0.40441500
         37.25450000          0.29631300
  1  0  0  1  1
          9.13198000          1.00000000
  1  0  0  1  1
          3.81779000          1.00000000
  1  0  0  1  1
          1.04935000          1.00000000
  1  0  0  1  1
          0.42866000          1.00000000
  1  0  0  1  1
          0.06282260          1.00000000
  1  0  0  1  1
          0.02601620          1.00000000
  1  1  1  3  1
       1019.76000000          0.00205986
        241.59600000          0.01665010
         77.63700000          0.07776460
  1  1  1  3  1
         29.11540000          0.24180600
         11.76260000          0.43257800
          4.92289000          0.36732500
  1  1  1  1  1
          1.90645000          1.00000000
  1  1  1  1  1
          0.73690000          1.00000000
  1  1  1  1  1
          0.27642000          1.00000000
  1  1  1  1  1
          0.06027000          1.00000000
  1  1  1  1  1
          0.01791000          1.00000000
  1  2  2  3  1
         15.08000000          0.03689470
          3.92600000          0.17782000
          1.23300000          0.42551300
  1  2  2  1  1
          0.26000000          1.00000000
# GALLIUM     (14s,12p,5d) -> [8s,7p,2d]
# GALLIUM     (1d)
GA 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     333800.00000000          0.00083805          0.00000000
      50100.00000000          0.00624660          0.00000000
      11510.00000000          0.03202800          0.00000000
       3292.00000000          0.12709000          0.00000000
       1089.00000000          0.39092000          0.00000000
        401.00000000          0.54643000          0.18078000
        159.30000000          0.00000000          0.62239000
         67.59000000          0.00000000          0.24953000
  1  0  0  1  1
         24.89000000          1.00000000
  1  0  0  1  1
         10.68000000          1.00000000
  1  0  0  1  1
          3.38600000          1.00000000
  1  0  0  1  1
          1.33100000          1.00000000
  1  0  0  1  1
          0.18530000          1.00000000
  1  0  0  1  1
          0.06621000          1.00000000
  1  1  1  3  1
       2181.00000000          0.02256500
        515.40000000          0.18363000
        164.80000000          0.85984000
  1  1  1  5  2
         61.40000000          0.34345000          0.00000000
         24.98000000          0.50561000          0.00000000
         10.44000000          0.26224000          0.06413000
          5.58900000          0.00000000          0.37884000
          2.51700000          0.00000000          0.61669000
  1  1  1  1  1
          1.05300000          1.00000000
  1  1  1  1  1
          0.29150000          1.00000000
  1  1  1  1  1
          0.12100000          1.00000000
  1  1  1  1  1
          0.03990000          1.00000000
  1  2  2  4  1
         67.14000000          0.03095700
         18.94000000          0.17480000
          6.42600000          0.44346000
          2.19000000          0.56702000
  1  2  2  1  1
          0.67250000          1.00000000
  1  2  2  1  1
          0.16900000          1.00000000
# GERMANIUM   (14s,12p,5d) -> [8s,7p,2d]
# GERMANIUM   (1d)
GE 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     357500.00000000          0.00083898          0.00000000
      53670.00000000          0.00626350          0.00000000
      12300.00000000          0.03203600          0.00000000
       3512.00000000          0.12751000          0.00000000
       1161.00000000          0.39165000          0.00000000
        428.00000000          0.54528000          0.18160000
        170.00000000          0.00000000          0.62248000
         72.06000000          0.00000000          0.24872000
  1  0  0  1  1
         26.69000000          1.00000000
  1  0  0  1  1
         11.50000000          1.00000000
  1  0  0  1  1
          3.74200000          1.00000000
  1  0  0  1  1
          1.49900000          1.00000000
  1  0  0  1  1
          0.22920000          1.00000000
  1  0  0  1  1
          0.08675000          1.00000000
  1  1  1  3  1
       2345.00000000          0.02251400
        554.20000000          0.18335000
        177.30000000          0.86003000
  1  1  1  5  2
         66.13000000          0.34306000          0.00000000
         26.90000000          0.50652000          0.00000000
         11.26000000          0.26141000          0.06724600
          6.11600000          0.00000000          0.37238000
          2.81900000          0.00000000          0.61763000
  1  1  1  1  1
          1.21100000          1.00000000
  1  1  1  1  1
          0.35680000          1.00000000
  1  1  1  1  1
          0.16210000          1.00000000
  1  1  1  1  1
          0.06084000          1.00000000
  1  2  2  4  1
         74.84000000          0.03039000
         21.23000000          0.17319000
          7.29700000          0.44090000
          2.54900000          0.56532000
  1  2  2  1  1
          0.81650000          1.00000000
  1  2  2  1  1
          0.22800000          1.00000000
# ARSENIC     (14s,12p,5d) -> [8s,7p,2d]
# ARSENIC     (1d)
AS 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     381200.00000000          0.00083327          0.00000000
      57240.00000000          0.00621980          0.00000000
      13110.00000000          0.03203000          0.00000000
       3743.00000000          0.12729000          0.00000000
       1238.00000000          0.39132000          0.00000000
        456.30000000          0.54581000          0.18097000
        181.40000000          0.00000000          0.62180000
         77.07000000          0.00000000          0.24988000
  1  0  0  1  1
         28.57000000          1.00000000
  1  0  0  1  1
         12.36000000          1.00000000
  1  0  0  1  1
          4.11700000          1.00000000
  1  0  0  1  1
          1.67800000          1.00000000
  1  0  0  1  1
          0.27610000          1.00000000
  1  0  0  1  1
          0.11050000          1.00000000
  1  1  1  3  1
       2528.00000000          0.02227100
        597.30000000          0.18199000
        190.70000000          0.86133000
  1  1  1  5  2
         70.96000000          0.34338000          0.00000000
         28.89000000          0.50598000          0.00000000
         12.13000000          0.26128000          0.06853600
          6.53300000          0.00000000          0.38282000
          3.02800000          0.00000000          0.60599000
  1  1  1  1  1
          1.34400000          1.00000000
  1  1  1  1  1
          0.58230000          1.00000000
  1  1  1  1  1
          0.25580000          1.00000000
  1  1  1  1  1
          0.08651000          1.00000000
  1  2  2  4  1
         86.05000000          0.02798900
         24.49000000          0.16502000
          8.44200000          0.43736000
          2.98100000          0.57255000
  1  2  2  1  1
          0.97900000          1.00000000
  1  2  2  1  1
          0.26400000          1.00000000
# SELENIUM    (14s,12p,5d) -> [8s,7p,2d]
# SELENIUM    (1d)
SE 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     405400.00000000          0.00083100          0.00000000
      60850.00000000          0.00623310          0.00000000
      13910.00000000          0.03207100          0.00000000
       3989.00000000          0.12636000          0.00000000
       1324.00000000          0.38899000          0.00000000
        487.00000000          0.54888000          0.17963000
        193.20000000          0.00000000          0.62227000
         82.19000000          0.00000000          0.25067000
  1  0  0  1  1
         30.52000000          1.00000000
  1  0  0  1  1
         13.25000000          1.00000000
  1  0  0  1  1
          4.51000000          1.00000000
  1  0  0  1  1
          1.86700000          1.00000000
  1  0  0  1  1
          0.31900000          1.00000000
  1  0  0  1  1
          0.11200000          1.00000000
  1  1  1  3  1
       2706.00000000          0.02214600
        638.60000000          0.18180000
        203.80000000          0.86155000
  1  1  1  5  2
         75.96000000          0.34243000          0.00000000
         31.02000000          0.50541000          0.00000000
         13.05000000          0.26237000          0.07016300
          6.98600000          0.00000000          0.38419000
          3.23400000          0.00000000          0.60368000
  1  1  1  1  1
          1.47500000          1.00000000
  1  1  1  1  1
          0.72750000          1.00000000
  1  1  1  1  1
          0.28690000          1.00000000
  1  1  1  1  1
          0.09679000          1.00000000
  1  2  2  4  1
         99.01000000          0.02559600
         28.41000000          0.15459000
          9.86300000          0.42878000
          3.51400000          0.58620000
  1  2  2  1  1
          1.17100000          1.00000000
  1  2  2  1  1
          0.30500000          1.00000000
# BROMINE     (14s,12p,5d) -> [8s,7p,2d]
# BROMINE     (1d)
BR 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     439700.00000000          0.00081300          0.00000000
      66030.00000000          0.00628500          0.00000000
      15140.00000000          0.03192000          0.00000000
       4317.00000000          0.12880000          0.00000000
       1414.00000000          0.39460000          0.00000000
        523.90000000          0.54130000          0.18310000
        207.70000000          0.00000000          0.61760000
         86.54000000          0.00000000          0.25380000
  1  0  0  1  1
         30.52000000          1.00000000
  1  0  0  1  1
         12.98000000          1.00000000
  1  0  0  1  1
          4.41200000          1.00000000
  1  0  0  1  1
          1.86200000          1.00000000
  1  0  0  1  1
          0.39320000          1.00000000
  1  0  0  1  1
          0.14000000          1.00000000
  1  1  1  3  1
       2957.00000000          0.02226000
        700.30000000          0.18020000
        224.60000000          0.86240000
  1  1  1  5  2
         82.59000000          0.34400000          0.00000000
         33.19000000          0.50710000          0.00000000
         14.20000000          0.25900000          0.07965000
          7.43800000          0.00000000          0.37340000
          3.52600000          0.00000000          0.60490000
  1  1  1  1  1
          1.59500000          1.00000000
  1  1  1  1  1
          0.84620000          1.00000000
  1  1  1  1  1
          0.31860000          1.00000000
  1  1  1  1  1
          0.10960000          1.00000000
  1  2  2  4  1
        134.80000000          0.01831000
         36.39000000          0.13500000
         12.16000000          0.42610000
          4.34100000          0.60430000
  1  2  2  1  1
          1.53500000          1.00000000
  1  2  2  1  1
          0.45100000          1.00000000
# KRYPTON     (14s,12p,5d) -> [8s,7p,2d]
# KRYPTON     (1d)
KR 6-311Gxx 6-311G**
 16
  1  0  0  8  2
     456200.00000000          0.00081110          0.00000000
      68460.00000000          0.00625520          0.00000000
      15650.00000000          0.03202200          0.00000000
       4500.00000000          0.12546000          0.00000000
       1497.00000000          0.38666000          0.00000000
        550.50000000          0.55188000          0.17711000
        218.20000000          0.00000000          0.62248000
         92.97000000          0.00000000          0.25279000
  1  0  0  1  1
         34.59000000          1.00000000
  1  0  0  1  1
         15.12000000          1.00000000
  1  0  0  1  1
          5.34600000          1.00000000
  1  0  0  1  1
          2.27300000          1.00000000
  1  0  0  1  1
          0.48410000          1.00000000
  1  0  0  1  1
          0.18490000          1.00000000
  1  1  1  3  1
       3074.00000000          0.02199800
        725.70000000          0.18102000
        231.50000000          0.86223000
  1  1  1  5  2
         86.45000000          0.34155000          0.00000000
         35.55000000          0.50255000          0.00000000
         15.14000000          0.26453000          0.07167000
          8.03100000          0.00000000          0.39708000
          3.79900000          0.00000000          0.58762000
  1  1  1  1  1
          1.84900000          1.00000000
  1  1  1  1  1
          0.86760000          1.00000000
  1  1  1  1  1
          0.33290000          1.00000000
  1  1  1  1  1
          0.11990000          1.00000000
  1  2  2  4  1
        122.50000000          0.02337700
         35.37000000          0.14610000
         12.39000000          0.42230000
          4.49600000          0.59452000
  1  2  2  1  1
          1.54600000          1.00000000
  1  2  2  1  1
          0.39500000          1.00000000
# IODINE      (15s,12p,6d) -> [10s,9p,4d]
# IODINE      (1d)
I  6-311Gxx 6-311G**
 24
  1  0  0  5  1
     444750.00000000          0.00089000
      66127.00000000          0.00694000
      14815.00000000          0.03609000
       4144.90000000          0.13568000
       1361.20000000          0.33878000
  1  0  0  2  1
        508.44000000          0.43659000
        209.59000000          0.18375000
  1  0  0  1  1
         81.95900000          1.00000000
  1  0  0  1  1
         36.80500000          1.00000000
  1  0  0  1  1
         13.49500000          1.00000000
  1  0  0  1  1
          6.88590000          1.00000000
  1  0  0  1  1
          2.55200000          1.00000000
  1  0  0  1  1
          1.20880000          1.00000000
  1  0  0  1  1
          0.27340000          1.00000000
  1  0  0  1  1
          0.10090000          1.00000000
  1  1  1  4  1
       2953.60000000          0.01221000
        712.61000000          0.08587000
        236.71000000          0.29493000
         92.63100000          0.47849000
  1  1  1  1  1
         39.73200000          1.00000000
  1  1  1  1  1
         17.27300000          1.00000000
  1  1  1  1  1
          7.95700000          1.00000000
  1  1  1  1  1
          3.15290000          1.00000000
  1  1  1  1  1
          1.33280000          1.00000000
  1  1  1  1  1
          0.49470000          1.00000000
  1  1  1  1  1
          0.21600000          1.00000000
  1  1  1  1  1
          0.08293000          1.00000000
  1  2  2  3  1
        261.95000000          0.03144000
         76.73400000          0.19028000
         27.55100000          0.47247000
  1  2  2  1  1
         10.60600000          1.00000000
  1  2  2  1  1
          3.42170000          1.00000000
  1  2  2  1  1
          1.13700000          1.00000000
  1  2  2  1  1
          0.30200000          1.00000000
# BASIS="6-311++G**"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H - Ar:  R. Krishnan, J.S. Binkley, R. Seeger, J.A. Pople, J. Chem. Phys. 72,
#         650 (1980)
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (1p)
# HYDROGEN    (Diffuse s)
H  6-311++Gxx 6-311++G**
  5
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (1p)
HE 6-311++Gxx 6-311++G**
  4
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (1d)
# LITHIUM     (Diffuse sp)
LI 6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  0  1  1  1  1
          0.00740000          1.00000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (1d)
# BERYLLIUM   (Diffuse sp)
BE 6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.25500000          1.00000000
  1  0  1  1  1  1
          0.02070000          1.00000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (1d)
# BORON       (Diffuse sp)
B  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.40100000          1.00000000
  1  0  1  1  1  1
          0.03150000          1.00000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (1d)
# CARBON      (Diffuse sp)
C  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          0.62600000          1.00000000
  1  0  1  1  1  1
          0.04380000          1.00000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (1d)
# NITROGEN    (Diffuse sp)
N  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          0.91300000          1.00000000
  1  0  1  1  1  1
          0.06390000          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (1d)
# OXYGEN      (Diffuse sp)
O  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          1.29200000          1.00000000
  1  0  1  1  1  1
          0.08450000          1.00000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (1d)
# FLUORINE    (Diffuse sp)
F  6-311++Gxx 6-311++G**
  6
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (1d)
NE 6-311++Gxx 6-311++G**
  5
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          2.30400000          1.00000000
# BASIS="6-311++G(2d,2p)"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H-Ne: M.J. Frisch, J.A. Pople and J.S. Binkley, J. Chem. Phys. 80, 3265 (1984)
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (2p)
# HYDROGEN    (Diffuse s)
H  6-311++G2d2p    6-311++G(2d,2p)
  6
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (2p)
HE 6-311++G2d2p    6-311++G(2d,2p)
  5
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (2d)
# LITHIUM     (Diffuse sp)
LI 6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  0  1  1  1  1
          0.00740000          1.00000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (2d)
# BERYLLIUM   (Diffuse sp)
BE 6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.51000000          1.00000000
  1  2  2  1  1
          0.12750000          1.00000000
  1  0  1  1  1  1
          0.02070000          1.00000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (2d)
# BORON       (Diffuse sp)
B  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.80200000          1.00000000
  1  2  2  1  1
          0.20050000          1.00000000
  1  0  1  1  1  1
          0.03150000          1.00000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (2d)
# CARBON      (Diffuse sp)
C  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          1.25200000          1.00000000
  1  2  2  1  1
          0.31300000          1.00000000
  1  0  1  1  1  1
          0.04380000          1.00000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (2d)
# NITROGEN    (Diffuse sp)
N  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          1.82600000          1.00000000
  1  2  2  1  1
          0.45650000          1.00000000
  1  0  1  1  1  1
          0.06390000          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (2d)
# OXYGEN      (Diffuse sp)
O  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          2.58400000          1.00000000
  1  2  2  1  1
          0.64600000          1.00000000
  1  0  1  1  1  1
          0.08450000          1.00000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (2d)
# FLUORINE    (Diffuse sp)
F  6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          2.39600000          1.00000000
  1  2  2  1  1
          0.87500000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (2d)
# NEON        (Diffuse sp)
NE 6-311++G2d2p    6-311++G(2d,2p)
  7
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          4.60800000          1.00000000
  1  2  2  1  1
          1.15200000          1.00000000
  1  0  1  1  1  1
          0.13000000          1.00000000          1.00000000
# SODIUM      (12s,9p) -> [6s,5p]
# SODIUM      (1d)
# SODIUM      (Diffuse sp)
NA 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212900          0.00000000
        339.62300000          0.16978900          0.00000000
        109.55300000          0.51462100          0.00000000
         38.77730000          0.37981700          0.37476200
         14.57590000          0.00000000          0.57576900
          5.26993000          0.00000000          0.11293300
  1  0  0  1  1
          1.82777000          1.00000000
  1  0  0  1  1
          0.61994800          1.00000000
  1  0  0  1  1
          0.05724000          1.00000000
  1  0  0  1  1
          0.02404800          1.00000000
  1  1  1  4  1
        144.64500000          0.01148500
         33.90740000          0.08238300
         10.62850000          0.31965800
          3.82389000          0.70129500
  1  1  1  2  1
          1.44429000          0.63850600
          0.55262100          0.42536500
  1  1  1  1  1
          0.18872000          1.00000000
  1  1  1  1  1
          0.04650100          1.00000000
  1  1  1  1  1
          0.01628500          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.08750000          1.00000000
  1  0  1  1  1  1
          0.00760000          1.00000000          1.00000000
# MAGNESIUM   (12s,9p) -> [6s,5p]
# MAGNESIUM   (1d)
# MAGNESIUM   (Diffuse sp)
MG 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      43866.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676400          0.00000000
         51.39830000          0.49797500          0.25135500
         19.91960000          0.00000000          0.61867100
          8.02474000          0.00000000          0.18841700
  1  0  0  1  1
          2.50817000          1.00000000
  1  0  0  1  1
          0.87153100          1.00000000
  1  0  0  1  1
          0.10818800          1.00000000
  1  0  0  1  1
          0.04013000          1.00000000
  1  1  1  4  1
        193.85400000          0.01018800
         45.44200000          0.07536000
         14.18640000          0.30741900
          5.05751000          0.71757500
  1  1  1  2  1
          1.88861000          0.66733900
          0.72265200          0.39464900
  1  1  1  1  1
          0.23641700          1.00000000
  1  1  1  1  1
          0.09335800          1.00000000
  1  1  1  1  1
          0.03480900          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.08750000          1.00000000
  1  0  1  1  1  1
          0.01460000          1.00000000          1.00000000
# ALUMINUM    (12s,9p) -> [6s,5p]
# ALUMINUM    (1d)
# ALUMINUM    (Diffuse sp)
AL 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      54866.48900000          0.00083900          0.00000000
       8211.76650000          0.00652700          0.00000000
       1866.17610000          0.03366600          0.00000000
        531.12934000          0.13290200          0.00000000
        175.11797000          0.40126600          0.00000000
         64.00550000          0.53133800          0.20230500
         25.29250700          0.00000000          0.62479000
         10.53491000          0.00000000          0.22743900
  1  0  0  1  1
          3.20671100          1.00000000
  1  0  0  1  1
          1.15255500          1.00000000
  1  0  0  1  1
          0.17667800          1.00000000
  1  0  0  1  1
          0.06523700          1.00000000
  1  1  1  4  1
        259.28362000          0.00944800
         61.07687000          0.07097400
         19.30323700          0.29563600
          7.01088200          0.72821900
  1  1  1  2  1
          2.67386500          0.64446700
          1.03659600          0.41741300
  1  1  1  1  1
          0.31681900          1.00000000
  1  1  1  1  1
          0.11425700          1.00000000
  1  1  1  1  1
          0.04139700          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.16250000          1.00000000
  1  0  1  1  1  1
          0.03180000          1.00000000          1.00000000
# SILICON     (12s,9p) -> [6s,5p]
# SILICON     (1d)
# SILICON     (Diffuse sp)
SI 6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.87960000          0.03108800          0.00000000
        657.14295000          0.12496700          0.00000000
        214.30113000          0.38689700          0.00000000
         77.62916800          0.55488800          0.17788100
         30.63080700          0.00000000          0.62776500
         12.80129500          0.00000000          0.24762300
  1  0  0  1  1
          3.92686600          1.00000000
  1  0  0  1  1
          1.45234300          1.00000000
  1  0  0  1  1
          0.25623400          1.00000000
  1  0  0  1  1
          0.09427900          1.00000000
  1  1  1  4  1
        335.48319000          0.00886600
         78.90036600          0.06829900
         24.98815000          0.29095800
          9.21971100          0.73211700
  1  1  1  2  1
          3.62114000          0.61987900
          1.45131000          0.43914800
  1  1  1  1  1
          0.50497700          1.00000000
  1  1  1  1  1
          0.18631700          1.00000000
  1  1  1  1  1
          0.06543200          1.00000000
  1  2  2  1  1
          0.90000000          1.00000000
  1  2  2  1  1
          0.22500000          1.00000000
  1  0  1  1  1  1
          0.03310000          1.00000000          1.00000000
# PHOSPHORUS  (12s,9p) -> [6s,5p]
# PHOSPHORUS  (1d)
# PHOSPHORUS  (Diffuse sp)
P  6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      77492.40000000          0.00078100          0.00000000
      11605.80000000          0.00606800          0.00000000
       2645.96000000          0.03116000          0.00000000
        754.97600000          0.12343100          0.00000000
        248.75500000          0.37820900          0.00000000
         91.15650000          0.56326200          0.16025500
         36.22570000          0.00000000          0.62764700
         15.21130000          0.00000000          0.26384900
  1  0  0  1  1
          4.79417000          1.00000000
  1  0  0  1  1
          1.80793000          1.00000000
  1  0  0  1  1
          0.35681600          1.00000000
  1  0  0  1  1
          0.11478300          1.00000000
  1  1  1  4  1
        384.84300000          0.00920600
         90.55210000          0.06987400
         29.13390000          0.29247000
         10.88620000          0.72810300
  1  1  1  2  1
          4.35259000          0.62834900
          1.77706000          0.42804400
  1  1  1  1  1
          0.69700500          1.00000000
  1  1  1  1  1
          0.25353200          1.00000000
  1  1  1  1  1
          0.06849300          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.27500000          1.00000000
  1  0  1  1  1  1
          0.03480000          1.00000000          1.00000000
# SULFUR      (12s,9p) -> [6s,5p]
# SULFUR      (1d)
# SULFUR      (Diffuse sp)
S  6-311++G2d2p    6-311++G(2d,2p)
 13
  1  0  0  8  2
      93413.40000000          0.00074300          0.00000000
      13961.70000000          0.00579300          0.00000000
       3169.91000000          0.02995400          0.00000000
        902.45600000          0.11902800          0.00000000
        297.15800000          0.36843200          0.00000000
        108.70200000          0.57729900          0.14318600
         43.15530000          0.00000000          0.62446500
         18.10790000          0.00000000          0.28336600
  1  0  0  1  1
          5.56009000          1.00000000
  1  0  0  1  1
          2.13183000          1.00000000
  1  0  0  1  1
          0.42040300          1.00000000
  1  0  0  1  1
          0.13604500          1.00000000
  1  1  1  4  1
        495.04000000          0.00830900
        117.22100000          0.06402400
         37.77490000          0.27761400
         14.05840000          0.74507600
  1  1  1  2  1
          5.56574000          0.61371200
          2.26297000          0.44381800
  1  1  1  1  1
          0.80799400          1.00000000
  1  1  1  1  1
          0.27746000          1.00000000
  1  1  1  1  1
          0.07714100          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  0  1  1  1  1
          0.04050000          1.00000000          1.00000000
# CHLORINE    (12s,9p) -> [6s,5p]
# CHLORINE    (1d)
# CHLORINE    (Diffuse sp)
CL 6-311++G2d2p    6-311++G(2d,2p)
 12
  1  0  0  8  2
     105819.00000000          0.00073800          0.00000000
      15872.00000000          0.00571800          0.00000000
       3619.65000000          0.02949500          0.00000000
       1030.80000000          0.11728600          0.00000000
        339.90800000          0.36294900          0.00000000
        124.53800000          0.58414900          0.13417700
         49.51350000          0.00000000          0.62425000
         20.80560000          0.00000000          0.29175600
  1  0  0  1  1
          6.58346000          1.00000000
  1  0  0  1  1
          2.56468000          1.00000000
  1  0  0  1  1
          0.55976300          1.00000000
  1  0  0  1  1
          0.18327300          1.00000000
  1  1  1  6  2
        589.77600000          0.00239100          0.00000000
        139.84900000          0.01850400          0.00000000
         45.14130000          0.08137700          0.00000000
         16.87330000          0.22155200          0.00000000
          6.74110000          0.77256900         -1.57224400
          2.77152000          0.00000000          0.99238900
  1  1  1  1  1
          1.02387000          1.00000000
  1  1  1  1  1
          0.38136800          1.00000000
  1  1  1  1  1
          0.10943700          1.00000000
  1  2  2  1  1
          1.50000000          1.00000000
  1  2  2  1  1
          0.37500000          1.00000000
  1  0  1  1  1  1
          0.04830000          1.00000000          1.00000000
# ARGON       (12s,9p) -> [6s,5p]
# ARGON       (1d)
# ARGON       (Diffuse sp)
AR 6-311++G2d2p    6-311++G(2d,2p)
 12
  1  0  0  8  2
     118022.38000000          0.00074700          0.00000000
      17683.54100000          0.00579000          0.00000000
       4027.76570000          0.02991900          0.00000000
       1145.39770000          0.11920600          0.00000000
        377.16375000          0.36902800          0.00000000
        138.15969000          0.57645900          0.14392700
         54.98911700          0.00000000          0.62293800
         23.17066700          0.00000000          0.28396400
  1  0  0  1  1
          7.37786000          1.00000000
  1  0  0  1  1
          2.92368800          1.00000000
  1  0  0  1  1
          0.65040500          1.00000000
  1  0  0  1  1
          0.23282500          1.00000000
  1  1  1  6  2
        663.06201000          0.00308200          0.00000000
        157.09281000          0.02416500          0.00000000
         50.23110000          0.10822300          0.00000000
         18.63534500          0.29419200          0.00000000
          7.44653700          0.68786200         -0.12144820
          3.09569800          0.00000000          0.16323700
  1  1  1  1  1
          1.10646300          1.00000000
  1  1  1  1  1
          0.41560100          1.00000000
  1  1  1  1  1
          0.14544900          1.00000000
  1  2  2  1  1
          1.70000000          1.00000000
  1  2  2  1  1
          0.42500000          1.00000000
  1  0  1  1  1  1
          0.06000000          1.00000000          1.00000000
# POTASSIUM   (14s,11p,3d) -> [8s,7p,1d]
# POTASSIUM   (1d)
# POTASSIUM   (Diffuse sp)
K  6-311++G2d2p    6-311++G(2d,2p)
 19
  1  0  0  6  1
     182594.00000000          0.00022775
      27369.00000000          0.00176640
       6229.17000000          0.00919497
       1764.58000000          0.03745510
        577.05100000          0.12204500
        210.24900000          0.29899000
  1  0  0  2  1
         82.61780000          0.40514700
         33.23320000          0.29253200
  1  0  0  1  1
          8.10649000          1.00000000
  1  0  0  1  1
          3.33403000          1.00000000
  1  0  0  1  1
          0.84554400          1.00000000
  1  0  0  1  1
          0.32821600          1.00000000
  1  0  0  1  1
          0.03640350          1.00000000
  1  0  0  1  1
          0.01764630          1.00000000
  1  1  1  3  1
        891.05400000          0.00218429
        211.01600000          0.01758910
         67.67140000          0.08177750
  1  1  1  3  1
         25.27150000          0.24565600
         10.13900000          0.43398400
          4.20186000          0.36237700
  1  1  1  1  1
          1.62507000          1.00000000
  1  1  1  1  1
          0.64377000          1.00000000
  1  1  1  1  1
          0.24613000          1.00000000
  1  1  1  1  1
          0.04544000          1.00000000
  1  1  1  1  1
          0.01616000          1.00000000
  1  2  2  3  1
         13.37000000          0.03160160
          3.42100000          0.15687900
          1.06300000          0.39058200
  1  2  2  1  1
          0.45800000          1.00000000
  1  2  2  1  1
          0.11450000          1.00000000
  1  0  1  1  1  1
          0.00470000          1.00000000          1.00000000
# CALCIUM     (14s,11p,3d) -> [8s,7p,1d]
# CALCIUM     (1d)
# CALCIUM     (Diffuse sp)
CA 6-311++G2d2p    6-311++G(2d,2p)
 19
  1  0  0  6  1
     202699.00000000          0.00022296
      30382.50000000          0.00172932
       6915.08000000          0.00900226
       1959.02000000          0.03666990
        640.93600000          0.11941000
        233.97700000          0.29182500
  1  0  0  2  1
         92.28920000          0.40441500
         37.25450000          0.29631300
  1  0  0  1  1
          9.13198000          1.00000000
  1  0  0  1  1
          3.81779000          1.00000000
  1  0  0  1  1
          1.04935000          1.00000000
  1  0  0  1  1
          0.42866000          1.00000000
  1  0  0  1  1
          0.06282260          1.00000000
  1  0  0  1  1
          0.02601620          1.00000000
  1  1  1  3  1
       1019.76000000          0.00205986
        241.59600000          0.01665010
         77.63700000          0.07776460
  1  1  1  3  1
         29.11540000          0.24180600
         11.76260000          0.43257800
          4.92289000          0.36732500
  1  1  1  1  1
          1.90645000          1.00000000
  1  1  1  1  1
          0.73690000          1.00000000
  1  1  1  1  1
          0.27642000          1.00000000
  1  1  1  1  1
          0.06027000          1.00000000
  1  1  1  1  1
          0.01791000          1.00000000
  1  2  2  3  1
         15.08000000          0.03689470
          3.92600000          0.17782000
          1.23300000          0.42551300
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.13000000          1.00000000
  1  0  1  1  1  1
          0.00710000          1.00000000          1.00000000
# BASIS="6-311G(2df,2pd)"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H-Ne: M.J. Frisch, J.A. Pople and J.S. Binkley, J. Chem. Phys. 80, 3265 (1984)
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (2p,1d)
H  6-311G2df2dp    6-311G(2df,2pd)
  6
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (2p,1d)
HE 6-311G2df2dp    6-311G(2df,2pd)
  6
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          1.50000000          1.00000000
  1  1  1  1  1
          0.37500000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (2d,1f)
LI 6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  3  3  1  1
          0.15000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (2d,1f)
BE 6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          0.51000000          1.00000000
  1  2  2  1  1
          0.12750000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (2d,1f)
B  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          0.80200000          1.00000000
  1  2  2  1  1
          0.20050000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (2d,1f)
C  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          1.25200000          1.00000000
  1  2  2  1  1
          0.31300000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (2d,1f)
N  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          1.82600000          1.00000000
  1  2  2  1  1
          0.45650000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (2d,1f)
O  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          2.58400000          1.00000000
  1  2  2  1  1
          0.64600000          1.00000000
  1  3  3  1  1
          1.40000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (2d,1f)
F  6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          2.39600000          1.00000000
  1  2  2  1  1
          0.87500000          1.00000000
  1  3  3  1  1
          1.85000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (2d,1f)
NE 6-311G2df2dp    6-311G(2df,2pd)
  7
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          4.60800000          1.00000000
  1  2  2  1  1
          1.15200000          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
# POTASSIUM   (14s,11p,3d) -> [8s,7p,1d]
# POTASSIUM   (1d)
K  6-311G2df2dp    6-311G(2df,2pd)
 19
  1  0  0  6  1
     182594.00000000          0.00022775
      27369.00000000          0.00176640
       6229.17000000          0.00919497
       1764.58000000          0.03745510
        577.05100000          0.12204500
        210.24900000          0.29899000
  1  0  0  2  1
         82.61780000          0.40514700
         33.23320000          0.29253200
  1  0  0  1  1
          8.10649000          1.00000000
  1  0  0  1  1
          3.33403000          1.00000000
  1  0  0  1  1
          0.84554400          1.00000000
  1  0  0  1  1
          0.32821600          1.00000000
  1  0  0  1  1
          0.03640350          1.00000000
  1  0  0  1  1
          0.01764630          1.00000000
  1  1  1  3  1
        891.05400000          0.00218429
        211.01600000          0.01758910
         67.67140000          0.08177750
  1  1  1  3  1
         25.27150000          0.24565600
         10.13900000          0.43398400
          4.20186000          0.36237700
  1  1  1  1  1
          1.62507000          1.00000000
  1  1  1  1  1
          0.64377000          1.00000000
  1  1  1  1  1
          0.24613000          1.00000000
  1  1  1  1  1
          0.04544000          1.00000000
  1  1  1  1  1
          0.01616000          1.00000000
  1  2  2  3  1
         13.37000000          0.03160160
          3.42100000          0.15687900
          1.06300000          0.39058200
  1  2  2  1  1
          0.45800000          1.00000000
  1  2  2  1  1
          0.11450000          1.00000000
  1  3  3  1  1
          1.11000000          1.00000000
# CALCIUM     (14s,11p,3d) -> [8s,7p,1d]
# CALCIUM     (1d)
CA 6-311G2df2dp    6-311G(2df,2pd)
 19
  1  0  0  6  1
     202699.00000000          0.00022296
      30382.50000000          0.00172932
       6915.08000000          0.00900226
       1959.02000000          0.03666990
        640.93600000          0.11941000
        233.97700000          0.29182500
  1  0  0  2  1
         92.28920000          0.40441500
         37.25450000          0.29631300
  1  0  0  1  1
          9.13198000          1.00000000
  1  0  0  1  1
          3.81779000          1.00000000
  1  0  0  1  1
          1.04935000          1.00000000
  1  0  0  1  1
          0.42866000          1.00000000
  1  0  0  1  1
          0.06282260          1.00000000
  1  0  0  1  1
          0.02601620          1.00000000
  1  1  1  3  1
       1019.76000000          0.00205986
        241.59600000          0.01665010
         77.63700000          0.07776460
  1  1  1  3  1
         29.11540000          0.24180600
         11.76260000          0.43257800
          4.92289000          0.36732500
  1  1  1  1  1
          1.90645000          1.00000000
  1  1  1  1  1
          0.73690000          1.00000000
  1  1  1  1  1
          0.27642000          1.00000000
  1  1  1  1  1
          0.06027000          1.00000000
  1  1  1  1  1
          0.01791000          1.00000000
  1  2  2  3  1
         15.08000000          0.03689470
          3.92600000          0.17782000
          1.23300000          0.42551300
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.13000000          1.00000000
  1  3  3  1  1
          1.33000000          1.00000000
# BASIS="6-311++G(3df,3pd)"
#Elements                             References
#--------                             ----------
#H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
#            J. Chem. Phys. 72, 650 (1980)
#Na - Ar:    A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
#K  - Ca:    J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
#            J. Chem. Phys. 107, 5016 (1997).
#Ga - Kr:    L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
#            R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
#I      :    M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
#            103, 1878 (1995)
#Elements                             References
#--------                             ----------
#H-Ne: M.J. Frisch, J.A. Pople and J.S. Binkley, J. Chem. Phys. 80, 3265 (1984)
#Elements                             Reference
#--------                             ----------
#H, Li-Cl: T. Clark, J. Chandrasekhar, P.V.R. Schleyer, J. Comp. Chem. 4, 294
#          (1983).
#
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (3p,1d)
# HYDROGEN    (Diffuse s)
H  6-311++G3df3pd    6-311++G(3df,3pd)
  8
  1  0  0  3  1
         33.86500000          0.02549380
          5.09479000          0.19037300
          1.15879000          0.85216100
  1  0  0  1  1
          0.32584000          1.00000000
  1  0  0  1  1
          0.10274100          1.00000000
  1  1  1  1  1
          3.00000000          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
  1  1  1  1  1
          0.18750000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  0  0  1  1
          0.03600000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (3p,1d)
HE 6-311++G3df3pd    6-311++G(3df,3pd)
  7
  1  0  0  3  1
         98.12430000          0.02874520
         14.76890000          0.20806100
          3.31883000          0.83763500
  1  0  0  1  1
          0.87404700          1.00000000
  1  0  0  1  1
          0.24456400          1.00000000
  1  1  1  1  1
          3.00000000          1.00000000
  1  1  1  1  1
          0.75000000          1.00000000
  1  1  1  1  1
          0.18750000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
# LITHIUM     (11s,5p) -> [4s,3p]
# LITHIUM     (3d,1f)
# LITHIUM     (Diffuse sp)
LI 6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
        900.46000000          0.00228704
        134.43300000          0.01763500
         30.43650000          0.08734340
          8.62639000          0.28097700
          2.48332000          0.65874100
          0.30317900          0.11871200
  1  0  1  3  1  1
          4.86890000          0.09332930          0.03276610
          0.85692400          0.94304500          0.15979200
          0.24322700         -0.00279827          0.88566700
  1  0  1  1  1  1
          0.06350700          1.00000000          1.00000000
  1  0  1  1  1  1
          0.02436830          1.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.05000000          1.00000000
  1  3  3  1  1
          0.15000000          1.00000000
  1  0  1  1  1  1
          0.00740000          1.00000000          1.00000000
# BERYLLIUM   (11s,5p) -> [4s,3p]
# BERYLLIUM   (3d,1f)
# BERYLLIUM   (Diffuse sp)
BE 6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       1682.80000000          0.00228574
        251.71500000          0.01759380
         57.41160000          0.08633150
         16.51710000          0.28183500
          4.85364000          0.64059400
          0.62686300          0.14446700
  1  0  1  3  1  1
          8.30938000          0.10862100          0.03613440
          1.74075000          0.92730100          0.21695800
          0.48581600         -0.00297169          0.84183900
  1  0  1  1  1  1
          0.16361300          1.00000000          1.00000000
  1  0  1  1  1  1
          0.05672850          1.00000000          1.00000000
  1  2  2  1  1
          1.02000000          1.00000000
  1  2  2  1  1
          0.25500000          1.00000000
  1  2  2  1  1
          0.06375000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
  1  0  1  1  1  1
          0.02070000          1.00000000          1.00000000
# BORON       (11s,5p) -> [4s,3p]
# BORON       (3d,1f)
# BORON       (Diffuse sp)
B  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       2858.89000000          0.00215375
        428.14000000          0.01658230
         97.52820000          0.08218700
         27.96930000          0.27661800
          8.21577000          0.62931600
          1.11278000          0.17377000
  1  0  1  3  1  1
         13.24150000          0.11744300          0.04181000
          3.00166000          0.91800200          0.23657500
          0.91285600         -0.00265105          0.81621400
  1  0  1  1  1  1
          0.31545400          1.00000000          1.00000000
  1  0  1  1  1  1
          0.09885630          1.00000000          1.00000000
  1  2  2  1  1
          1.60400000          1.00000000
  1  2  2  1  1
          0.40100000          1.00000000
  1  2  2  1  1
          0.10025000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  0  1  1  1  1
          0.03150000          1.00000000          1.00000000
# CARBON      (11s,5p) -> [4s,3p]
# CARBON      (3d,1f)
# CARBON      (Diffuse sp)
C  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       4563.24000000          0.00196665
        682.02400000          0.01523060
        154.97300000          0.07612690
         44.45530000          0.26080100
         13.02900000          0.61646200
          1.82773000          0.22100600
  1  0  1  3  1  1
         20.96420000          0.11466000          0.04024870
          4.80331000          0.91999900          0.23759400
          1.45933000         -0.00303068          0.81585400
  1  0  1  1  1  1
          0.48345600          1.00000000          1.00000000
  1  0  1  1  1  1
          0.14558500          1.00000000          1.00000000
  1  2  2  1  1
          2.50400000          1.00000000
  1  2  2  1  1
          0.62600000          1.00000000
  1  2  2  1  1
          0.15650000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  0  1  1  1  1
          0.04380000          1.00000000          1.00000000
# NITROGEN    (11s,5p) -> [4s,3p]
# NITROGEN    (3d,1f)
# NITROGEN    (Diffuse sp)
N  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       6293.48000000          0.00196979
        949.04400000          0.01496130
        218.77600000          0.07350060
         63.69160000          0.24893700
         18.82820000          0.60246000
          2.72023000          0.25620200
  1  0  1  3  1  1
         30.63310000          0.11190600          0.03831190
          7.02614000          0.92166600          0.23740300
          2.11205000         -0.00256919          0.81759200
  1  0  1  1  1  1
          0.68400900          1.00000000          1.00000000
  1  0  1  1  1  1
          0.20087800          1.00000000          1.00000000
  1  2  2  1  1
          3.65200000          1.00000000
  1  2  2  1  1
          0.91300000          1.00000000
  1  2  2  1  1
          0.22825000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
  1  0  1  1  1  1
          0.06390000          1.00000000          1.00000000
# OXYGEN      (11s,5p) -> [4s,3p]
# OXYGEN      (3d,1f)
# OXYGEN      (Diffuse sp)
O  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
       8588.50000000          0.00189515
       1297.23000000          0.01438590
        299.29600000          0.07073200
         87.37710000          0.24000100
         25.67890000          0.59479700
          3.74004000          0.28080200
  1  0  1  3  1  1
         42.11750000          0.11388900          0.03651140
          9.62837000          0.92081100          0.23715300
          2.85332000         -0.00327447          0.81970200
  1  0  1  1  1  1
          0.90566100          1.00000000          1.00000000
  1  0  1  1  1  1
          0.25561100          1.00000000          1.00000000
  1  2  2  1  1
          5.16000000          1.00000000
  1  2  2  1  1
          1.29200000          1.00000000
  1  2  2  1  1
          0.32250000          1.00000000
  1  3  3  1  1
          1.40000000          1.00000000
  1  0  1  1  1  1
          0.08450000          1.00000000          1.00000000
# FLUORINE    (11s,5p) -> [4s,3p]
# FLUORINE    (3d,1f)
# FLUORINE    (Diffuse sp)
F  6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
      11427.10000000          0.00180093
       1722.35000000          0.01374190
        395.74600000          0.06813340
        115.13900000          0.23332500
         33.60260000          0.58908600
          4.91901000          0.29950500
  1  0  1  3  1  1
         55.44410000          0.11453600          0.03546090
         12.63230000          0.92051200          0.23745100
          3.71756000         -0.00337804          0.82045800
  1  0  1  1  1  1
          1.16545000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.32189200          1.00000000          1.00000000
  1  2  2  1  1
          7.00000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.43750000          1.00000000
  1  3  3  1  1
          1.85000000          1.00000000
  1  0  1  1  1  1
          0.10760000          1.00000000          1.00000000
# NEON        (11s,5p) -> [4s,3p]
# NEON        (3d,1f)
# NEON        (Diffuse sp)
NE 6-311++G3df3pd    6-311++G(3df,3pd)
  9
  1  0  0  6  1
      13995.70000000          0.00183276
       2117.10000000          0.01388270
        490.42500000          0.06806870
        143.83300000          0.23132800
         41.92650000          0.58589000
          6.15684000          0.30588300
  1  0  1  3  1  1
         69.12110000          0.11914900          0.03565740
         15.83500000          0.91737500          0.23947700
          4.67326000         -0.00405839          0.81846100
  1  0  1  1  1  1
          1.45756000          1.00000000          1.00000000
  1  0  1  1  1  1
          0.39705700          1.00000000          1.00000000
  1  2  2  1  1
          9.21600000          1.00000000
  1  2  2  1  1
          2.30400000          1.00000000
  1  2  2  1  1
          0.57600000          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
  1  0  1  1  1  1
          0.13000000          1.00000000          1.00000000
# SODIUM      (12s,9p) -> [6s,5p]
# SODIUM      (3d,1f)
# SODIUM      (Diffuse sp)
NA 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212900          0.00000000
        339.62300000          0.16978900          0.00000000
        109.55300000          0.51462100          0.00000000
         38.77730000          0.37981700          0.37476200
         14.57590000          0.00000000          0.57576900
          5.26993000          0.00000000          0.11293300
  1  0  0  1  1
          1.82777000          1.00000000
  1  0  0  1  1
          0.61994800          1.00000000
  1  0  0  1  1
          0.05724000          1.00000000
  1  0  0  1  1
          0.02404800          1.00000000
  1  1  1  4  1
        144.64500000          0.01148500
         33.90740000          0.08238300
         10.62850000          0.31965800
          3.82389000          0.70129500
  1  1  1  2  1
          1.44429000          0.63850600
          0.55262100          0.42536500
  1  1  1  1  1
          0.18872000          1.00000000
  1  1  1  1  1
          0.04650100          1.00000000
  1  1  1  1  1
          0.01628500          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
  1  2  2  1  1
          0.04375000          1.00000000
  1  3  3  1  1
          0.15000000          1.00000000
  1  0  1  1  1  1
          0.00760000          1.00000000          1.00000000
# MAGNESIUM   (12s,9p) -> [6s,5p]
# MAGNESIUM   (3d,1f)
# MAGNESIUM   (Diffuse sp)
MG 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      43866.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676400          0.00000000
         51.39830000          0.49797500          0.25135500
         19.91960000          0.00000000          0.61867100
          8.02474000          0.00000000          0.18841700
  1  0  0  1  1
          2.50817000          1.00000000
  1  0  0  1  1
          0.87153100          1.00000000
  1  0  0  1  1
          0.10818800          1.00000000
  1  0  0  1  1
          0.04013000          1.00000000
  1  1  1  4  1
        193.85400000          0.01018800
         45.44200000          0.07536000
         14.18640000          0.30741900
          5.05751000          0.71757500
  1  1  1  2  1
          1.88861000          0.66733900
          0.72265200          0.39464900
  1  1  1  1  1
          0.23641700          1.00000000
  1  1  1  1  1
          0.09335800          1.00000000
  1  1  1  1  1
          0.03480900          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.17500000          1.00000000
  1  2  2  1  1
          0.04375000          1.00000000
  1  3  3  1  1
          0.20000000          1.00000000
  1  0  1  1  1  1
          0.01460000          1.00000000          1.00000000
# ALUMINUM    (12s,9p) -> [6s,5p]
# ALUMINUM    (3d,1f)
# ALUMINUM    (Diffuse sp)
AL 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      54866.48900000          0.00083900          0.00000000
       8211.76650000          0.00652700          0.00000000
       1866.17610000          0.03366600          0.00000000
        531.12934000          0.13290200          0.00000000
        175.11797000          0.40126600          0.00000000
         64.00550000          0.53133800          0.20230500
         25.29250700          0.00000000          0.62479000
         10.53491000          0.00000000          0.22743900
  1  0  0  1  1
          3.20671100          1.00000000
  1  0  0  1  1
          1.15255500          1.00000000
  1  0  0  1  1
          0.17667800          1.00000000
  1  0  0  1  1
          0.06523700          1.00000000
  1  1  1  4  1
        259.28362000          0.00944800
         61.07687000          0.07097400
         19.30323700          0.29563600
          7.01088200          0.72821900
  1  1  1  2  1
          2.67386500          0.64446700
          1.03659600          0.41741300
  1  1  1  1  1
          0.31681900          1.00000000
  1  1  1  1  1
          0.11425700          1.00000000
  1  1  1  1  1
          0.04139700          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  2  2  1  1
          0.08125000          1.00000000
  1  3  3  1  1
          0.25000000          1.00000000
  1  0  1  1  1  1
          0.03180000          1.00000000          1.00000000
# SILICON     (12s,9p) -> [6s,5p]
# SILICON     (3d,1f)
# SILICON     (Diffuse sp)
SI 6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.87960000          0.03108800          0.00000000
        657.14295000          0.12496700          0.00000000
        214.30113000          0.38689700          0.00000000
         77.62916800          0.55488800          0.17788100
         30.63080700          0.00000000          0.62776500
         12.80129500          0.00000000          0.24762300
  1  0  0  1  1
          3.92686600          1.00000000
  1  0  0  1  1
          1.45234300          1.00000000
  1  0  0  1  1
          0.25623400          1.00000000
  1  0  0  1  1
          0.09427900          1.00000000
  1  1  1  4  1
        335.48319000          0.00886600
         78.90036600          0.06829900
         24.98815000          0.29095800
          9.21971100          0.73211700
  1  1  1  2  1
          3.62114000          0.61987900
          1.45131000          0.43914800
  1  1  1  1  1
          0.50497700          1.00000000
  1  1  1  1  1
          0.18631700          1.00000000
  1  1  1  1  1
          0.06543200          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          0.11250000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  0  1  1  1  1
          0.03310000          1.00000000          1.00000000
# PHOSPHORUS  (12s,9p) -> [6s,5p]
# PHOSPHORUS  (3d,1f)
# PHOSPHORUS  (Diffuse sp)
P  6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      77492.40000000          0.00078100          0.00000000
      11605.80000000          0.00606800          0.00000000
       2645.96000000          0.03116000          0.00000000
        754.97600000          0.12343100          0.00000000
        248.75500000          0.37820900          0.00000000
         91.15650000          0.56326200          0.16025500
         36.22570000          0.00000000          0.62764700
         15.21130000          0.00000000          0.26384900
  1  0  0  1  1
          4.79417000          1.00000000
  1  0  0  1  1
          1.80793000          1.00000000
  1  0  0  1  1
          0.35681600          1.00000000
  1  0  0  1  1
          0.11478300          1.00000000
  1  1  1  4  1
        384.84300000          0.00920600
         90.55210000          0.06987400
         29.13390000          0.29247000
         10.88620000          0.72810300
  1  1  1  2  1
          4.35259000          0.62834900
          1.77706000          0.42804400
  1  1  1  1  1
          0.69700500          1.00000000
  1  1  1  1  1
          0.25353200          1.00000000
  1  1  1  1  1
          0.06849300          1.00000000
  1  2  2  1  1
          2.20000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.13750000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  0  1  1  1  1
          0.03480000          1.00000000          1.00000000
# SULFUR      (12s,9p) -> [6s,5p]
# SULFUR      (3d,1f)
# SULFUR      (Diffuse sp)
S  6-311++G3df3pd    6-311++G(3df,3pd)
 15
  1  0  0  8  2
      93413.40000000          0.00074300          0.00000000
      13961.70000000          0.00579300          0.00000000
       3169.91000000          0.02995400          0.00000000
        902.45600000          0.11902800          0.00000000
        297.15800000          0.36843200          0.00000000
        108.70200000          0.57729900          0.14318600
         43.15530000          0.00000000          0.62446500
         18.10790000          0.00000000          0.28336600
  1  0  0  1  1
          5.56009000          1.00000000
  1  0  0  1  1
          2.13183000          1.00000000
  1  0  0  1  1
          0.42040300          1.00000000
  1  0  0  1  1
          0.13604500          1.00000000
  1  1  1  4  1
        495.04000000          0.00830900
        117.22100000          0.06402400
         37.77490000          0.27761400
         14.05840000          0.74507600
  1  1  1  2  1
          5.56574000          0.61371200
          2.26297000          0.44381800
  1  1  1  1  1
          0.80799400          1.00000000
  1  1  1  1  1
          0.27746000          1.00000000
  1  1  1  1  1
          0.07714100          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.16250000          1.00000000
  1  3  3  1  1
          0.55000000          1.00000000
  1  0  1  1  1  1
          0.04050000          1.00000000          1.00000000
# CHLORINE    (12s,9p) -> [6s,5p]
# CHLORINE    (3d,1f)
# CHLORINE    (Diffuse sp)
CL 6-311++G3df3pd    6-311++G(3df,3pd)
 14
  1  0  0  8  2
     105819.00000000          0.00073800          0.00000000
      15872.00000000          0.00571800          0.00000000
       3619.65000000          0.02949500          0.00000000
       1030.80000000          0.11728600          0.00000000
        339.90800000          0.36294900          0.00000000
        124.53800000          0.58414900          0.13417700
         49.51350000          0.00000000          0.62425000
         20.80560000          0.00000000          0.29175600
  1  0  0  1  1
          6.58346000          1.00000000
  1  0  0  1  1
          2.56468000          1.00000000
  1  0  0  1  1
          0.55976300          1.00000000
  1  0  0  1  1
          0.18327300          1.00000000
  1  1  1  6  2
        589.77600000          0.00239100          0.00000000
        139.84900000          0.01850400          0.00000000
         45.14130000          0.08137700          0.00000000
         16.87330000          0.22155200          0.00000000
          6.74110000          0.77256900         -1.57224400
          2.77152000          0.00000000          0.99238900
  1  1  1  1  1
          1.02387000          1.00000000
  1  1  1  1  1
          0.38136800          1.00000000
  1  1  1  1  1
          0.10943700          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.18750000          1.00000000
  1  3  3  1  1
          0.70000000          1.00000000
  1  0  1  1  1  1
          0.04830000          1.00000000          1.00000000
# ARGON       (12s,9p) -> [6s,5p]
# ARGON       (3d,1f)
# ARGON       (Diffuse sp)
AR 6-311++G3df3pd    6-311++G(3df,3pd)
 14
  1  0  0  8  2
     118022.38000000          0.00074700          0.00000000
      17683.54100000          0.00579000          0.00000000
       4027.76570000          0.02991900          0.00000000
       1145.39770000          0.11920600          0.00000000
        377.16375000          0.36902800          0.00000000
        138.15969000          0.57645900          0.14392700
         54.98911700          0.00000000          0.62293800
         23.17066700          0.00000000          0.28396400
  1  0  0  1  1
          7.37786000          1.00000000
  1  0  0  1  1
          2.92368800          1.00000000
  1  0  0  1  1
          0.65040500          1.00000000
  1  0  0  1  1
          0.23282500          1.00000000
  1  1  1  6  2
        663.06201000          0.00308200          0.00000000
        157.09281000          0.02416500          0.00000000
         50.23110000          0.10822300          0.00000000
         18.63534500          0.29419200          0.00000000
          7.44653700          0.68786200         -0.12144820
          3.09569800          0.00000000          0.16323700
  1  1  1  1  1
          1.10646300          1.00000000
  1  1  1  1  1
          0.41560100          1.00000000
  1  1  1  1  1
          0.14544900          1.00000000
  1  2  2  1  1
          3.40000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
  1  2  2  1  1
          0.21250000          1.00000000
  1  3  3  1  1
          0.85000000          1.00000000
  1  0  1  1  1  1
          0.06000000          1.00000000          1.00000000
#  pc-0  EMSL  Basis Set Exchange Library  6/6/08 12:12 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
#
# HYDROGEN
H  pc-0
  2
  1  0  0  2  1
          4.34480000          0.07929900
          0.66049000          0.42422000
  1  0  0  1  1
          0.13669000          1.00000000
# HELIUM
He pc-0
  2
  1  0  0  2  1
         13.21000000          0.04350600
          1.94340000          0.21166000
  1  0  0  1  1
          0.35443000          1.00000000
# LITHIUM
Li pc-0
  3
  1  0  0  4  2
         97.58500000          0.02235800          0.00000000
         14.75500000          0.14499000          0.00518750
          3.22330000          0.34594000          0.16698000
          0.78789000          0.00000000          0.72566000
  1  0  0  1  1
          0.05100900          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
# BERYLLIUM
Be pc-0
  3
  1  0  0  4  2
        187.54000000          0.01037300          0.00000000
         28.34500000          0.07200700         -0.00205070
          6.26140000          0.13085000          0.11312000
          1.58370000          0.00000000          0.30800000
  1  0  0  1  1
          0.10858000          1.00000000
  1  1  1  1  1
          0.43000000          1.00000000
# BORON
B  pc-0
  4
  1  0  0  4  2
        303.73000000          0.02012100          0.00000000
         45.89400000          0.14410000         -0.00738180
         10.20500000          0.21961000          0.26153000
          2.63480000          0.00000000          0.59363000
  1  0  0  1  1
          0.19380000          1.00000000
  1  1  1  2  1
          2.79040000          0.10986000
          0.54195000          0.46846000
  1  1  1  1  1
          0.11876000          1.00000000
# CARBON
C  pc-0
  4
  1  0  0  4  2
        446.51000000          0.01978800          0.00000000
         67.46200000          0.14534000         -0.00999100
         15.06700000          0.18529000          0.28519000
          3.93880000          0.00000000          0.56687000
  1  0  0  1  1
          0.29991000          1.00000000
  1  1  1  2  1
          4.36770000          0.11671000
          0.86982000          0.47558000
  1  1  1  1  1
          0.18893000          1.00000000
# NITROGEN
N  pc-0
  4
  1  0  0  4  2
        615.85000000          0.01958800          0.00000000
         93.04400000          0.14695000         -0.01205900
         20.84800000          0.15560000          0.30199000
          5.49590000          0.00000000          0.54090000
  1  0  0  1  1
          0.42624000          1.00000000
  1  1  1  2  1
          6.26800000          0.12134000
          1.26900000          0.48013000
  1  1  1  1  1
          0.27390000          1.00000000
# OXYGEN
O  pc-0
  4
  1  0  0  4  2
        812.12000000          0.01945000          0.00000000
        122.69000000          0.14774000         -0.01318900
         27.56100000          0.13593000          0.31510000
          7.31730000          0.00000000          0.52964000
  1  0  0  1  1
          0.57924000          1.00000000
  1  1  1  2  1
          8.21780000          0.12902000
          1.67540000          0.48706000
  1  1  1  1  1
          0.35067000          1.00000000
# FLUORINE
F  pc-0
  4
  1  0  0  4  2
       1035.10000000          0.01935100          0.00000000
        156.38000000          0.14884000         -0.01433700
         35.19600000          0.11735000          0.32551000
          9.39210000          0.00000000          0.51681000
  1  0  0  1  1
          0.75342000          1.00000000
  1  1  1  2  1
         10.59900000          0.13273000
          2.17330000          0.48938000
  1  1  1  1  1
          0.44871000          1.00000000
# NEON
Ne pc-0
  4
  1  0  0  4  2
       1284.50000000          0.09641900          0.00000000
        194.05000000          0.75019000         -0.00767080
         43.74600000          0.49765000          0.16693000
         11.72000000          0.00000000          0.25151000
  1  0  0  1  1
          0.94746000          1.00000000
  1  1  1  2  1
         13.34800000          0.06746700
          2.75090000          0.24531000
  1  1  1  1  1
          0.56434000          1.00000000
# SODIUM
Na pc-0
  4
  1  0  0  7  3
       4553.50000000          0.00515830          0.00000000          0.00000000
        685.09000000          0.03860000         -0.00031854          0.00000000
        155.73000000          0.17385000         -0.00226480         -0.00007913
         43.37100000          0.45646000         -0.03392300         -0.00069906
         13.33900000          0.46291000         -0.07630900         -0.00320830
          2.31060000          0.00000000          0.33727000          0.03005600
          0.70669000          0.00000000          0.00000000          0.11224000
  1  0  0  1  1
          0.04594200          1.00000000
  1  1  1  4  1
         37.79300000          0.04649500
          8.41340000          0.24311000
          2.32100000          0.51738000
          0.60658000          0.42598000
  1  1  1  1  1
          0.09500000          1.00000000
# MAGNESIUM
Mg pc-0
  4
  1  0  0  7  3
       5520.80000000          0.00252540          0.00000000          0.00000000
        830.56000000          0.01893200         -0.00015190          0.00000000
        188.81000000          0.08556500         -0.00087484         -0.00116040
         52.63800000          0.22776000         -0.01460700         -0.00988450
         16.23300000          0.23565000         -0.03034900         -0.04341600
          2.92750000          0.00000000          0.10360000          0.31196000
          0.94786000          0.00000000          0.00000000          0.72645000
  1  0  0  1  1
          0.07636100          1.00000000
  1  1  1  4  1
         49.45300000          0.02173900
         11.11600000          0.11690000
          3.12730000          0.25993000
          0.85940000          0.21108000
  1  1  1  1  1
          0.16000000          1.00000000
# ALUMINUM
Al pc-0
  4
  1  0  0  7  3
       6587.10000000          0.00495700          0.00000000          0.00000000
        990.92000000          0.03722300         -0.00029525          0.00000000
        225.29000000          0.16875000         -0.00156740         -0.00034383
         62.86600000          0.45505000         -0.02743400         -0.00293810
         19.43200000          0.48010000         -0.05560000         -0.01304700
          3.62070000          0.00000000          0.15188000          0.08567900
          1.22880000          0.00000000          0.00000000          0.18025000
  1  0  0  1  1
          0.12068000          1.00000000
  1  1  1  5  2
         72.36500000          0.03295300          0.00000000
         16.54300000          0.18989000         -0.00030607
          4.82390000          0.47489000         -0.00812540
          1.43360000          0.48033000          0.00582160
          0.27689000          0.00000000          0.37831000
  1  1  1  1  1
          0.06985600          1.00000000
# SILICON
Si pc-0
  4
  1  0  0  7  3
       7743.00000000          0.00488250          0.00000000          0.00000000
       1164.70000000          0.03674100         -0.00029111          0.00000000
        264.82000000          0.16695000         -0.00141220         -0.00044437
         73.96800000          0.45657000         -0.02604600         -0.00380670
         22.91200000          0.49043000         -0.05093300         -0.01707800
          4.37410000          0.00000000          0.10810000          0.10569000
          1.53910000          0.00000000          0.00000000          0.20429000
  1  0  0  1  1
          0.16775000          1.00000000
  1  1  1  5  2
         96.08000000          0.02803500          0.00000000
         22.15000000          0.16819000         -0.00072797
          6.56300000          0.45197000         -0.00866440
          2.02500000          0.50132000         -0.00353440
          0.47780000          0.00000000          0.31085000
  1  1  1  1  1
          0.12824000          1.00000000
# PHOSPHOROUS
P  pc-0
  4
  1  0  0  7  3
       8990.80000000          0.00482060          0.00000000          0.00000000
       1352.40000000          0.03639200          0.00289000          0.00000000
        307.50000000          0.16563000          0.01263800         -0.00054512
         85.94100000          0.46217000          0.24790000         -0.00468380
         26.67100000          0.50582000          0.46165000         -0.02116000
          5.18810000          0.00000000         -0.70180000          0.12534000
          1.87780000          0.00000000          0.00000000          0.22427000
  1  0  0  1  1
          0.22010000          1.00000000
  1  1  1  5  2
        111.64000000          0.02866300          0.00000000
         25.78400000          0.17265000         -0.00068545
          7.67250000          0.46181000         -0.01129600
          2.39960000          0.49174000          0.00329620
          0.54943000          0.00000000          0.41613000
  1  1  1  1  1
          0.14748000          1.00000000
# SULFUR
S  pc-0
  4
  1  0  0  7  3
      10330.00000000          0.00476850          0.00000000          0.00000000
       1553.70000000          0.03620900          0.00289030          0.00000000
        353.30000000          0.16491000          0.01157500         -0.00062501
         98.80500000          0.47548000          0.23993000         -0.00538810
         30.71600000          0.53319000          0.42830000         -0.02452100
          6.06330000          0.00000000         -0.42063000          0.14132000
          2.24750000          0.00000000          0.00000000          0.23948000
  1  0  0  1  1
          0.27853000          1.00000000
  1  1  1  5  2
        129.76000000          0.02870600          0.00000000
         30.02500000          0.17420000         -0.00011785
          8.97330000          0.46709000         -0.01448300
          2.84400000          0.48571000          0.01593900
          0.63361000          0.00000000          0.48257000
  1  1  1  1  1
          0.16955000          1.00000000
# CHLORINE
Cl pc-0
  4
  1  0  0  7  3
      11759.00000000          0.00472480          0.00000000          0.00000000
       1768.60000000          0.03654600          0.00290530          0.00000000
        402.19000000          0.16597000          0.01066400         -0.00069197
        112.54000000          0.52530000          0.23406000         -0.00597600
         35.03900000          0.61955000          0.39915000         -0.02739400
          6.99560000          0.00000000         -0.17937000          0.15516000
          2.64550000          0.00000000          0.00000000          0.25028000
  1  0  0  1  1
          0.34157000          1.00000000
  1  1  1  5  2
        150.66000000          0.02829900          0.00000000
         34.93300000          0.17336000          0.00013598
         10.49200000          0.46812000         -0.01661100
          3.37260000          0.48321000          0.02235100
          0.75989000          0.00000000          0.51192000
  1  1  1  1  1
          0.20289000          1.00000000
# ARGON
Ar pc-0
  4
  1  0  0  7  3
      13277.00000000          0.02344000          0.00000000          0.00000000
       1996.90000000          0.15225000          0.00146890          0.00000000
        454.12000000          0.72536000          0.00492820         -0.00037469
        127.14000000          0.33180000          0.11458000         -0.00324620
         39.63700000         -0.63751000          0.18548000         -0.01496800
          7.98170000          0.00000000          0.02189400          0.08393600
          3.07060000          0.00000000          0.00000000          0.12891000
  1  0  0  1  1
          0.40908000          1.00000000
  1  1  1  5  2
        173.23000000          0.01395500          0.00000000
         40.23900000          0.08622600          0.00013131
         12.13900000          0.23423000         -0.00914820
          3.95270000          0.24062000          0.01328000
          0.90626000          0.00000000          0.26503000
  1  1  1  1  1
          0.24252000          1.00000000
#  pc-1  EMSL  Basis Set Exchange Library  6/6/08 12:12 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
#
# HYDROGEN
H  pc-1
  3
  1  0  0  3  1
         12.25200000          0.02282200
          1.86870000          0.15564000
          0.41821000          0.48898000
  1  0  0  1  1
          0.10610000          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
# HELIUM
He pc-1
  3
  1  0  0  3  1
         36.86500000          0.01306200
          5.58020000          0.08349100
          1.19170000          0.23874000
  1  0  0  1  1
          0.26892000          1.00000000
  1  1  1  1  1
          1.45000000          1.00000000
# LITHIUM
Li pc-1
  4
  1  0  0  6  2
        266.43000000          0.00652680          0.00000000
         40.16000000          0.04806500          0.00001102
          9.10820000          0.20095000         -0.00268490
          2.45430000          0.47007000         -0.01871100
          0.69626000          0.43130000         -0.08894800
          0.08372600          0.00000000          0.51836000
  1  0  0  1  1
          0.03082700          1.00000000
  1  1  1  2  1
          1.62000000          0.04165510
          0.32000000          0.11044500
  1  1  1  1  1
          0.09000000          1.00000000
# BERYLLIUM
Be pc-1
  4
  1  0  0  6  2
        514.90000000          0.00300310          0.00000000
         77.55800000          0.02224300         -0.00009600
         17.60900000          0.09543400         -0.00121790
          4.80800000          0.23228000         -0.01369900
          1.40850000          0.22104000         -0.04215900
          0.19069000          0.00000000          0.26185000
  1  0  0  1  1
          0.06112500          1.00000000
  1  1  1  2  1
          3.42000000          0.04935190
          0.68000000          0.18982100
  1  1  1  1  1
          0.19000000          1.00000000
# BORON
B  pc-1
  5
  1  0  0  6  2
        843.98000000          0.00573610          0.00000000
        127.08000000          0.04262500         -0.00023303
         28.86200000          0.18576000         -0.00254790
          7.92970000          0.46258000         -0.03092800
          2.36370000          0.44646000         -0.08695600
          0.34670000          0.00000000          0.53062000
  1  0  0  1  1
          0.10595000          1.00000000
  1  1  1  3  1
          5.81280000          0.04308400
          1.20020000          0.22295000
          0.32686000          0.50977000
  1  1  1  1  1
          0.08626400          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
# CARBON
C  pc-1
  5
  1  0  0  6  2
       1252.60000000          0.00557360          0.00000000
        188.57000000          0.04149600         -0.00027440
         42.83900000          0.18263000         -0.00255830
         11.81800000          0.46129000         -0.03337500
          3.55670000          0.44931000         -0.08730500
          0.54258000          0.00000000          0.53415000
  1  0  0  1  1
          0.16058000          1.00000000
  1  1  1  3  1
          9.14260000          0.04449900
          1.92980000          0.23108000
          0.52522000          0.51227000
  1  1  1  1  1
          0.13608000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN
N  pc-1
  5
  1  0  0  6  2
       1742.20000000          0.00546030          0.00000000
        262.21000000          0.04070600         -0.00030104
         59.58500000          0.18038000         -0.00255110
         16.48900000          0.46009000         -0.03490000
          4.99450000          0.45173000         -0.08742900
          0.78673000          0.00000000          0.52660000
  1  0  0  1  1
          0.22837000          1.00000000
  1  1  1  3  1
         13.13200000          0.04551500
          2.81080000          0.23740000
          0.76351000          0.51392000
  1  1  1  1  1
          0.19560000          1.00000000
  1  2  2  1  1
          0.90000000          1.00000000
# OXYGEN
O  pc-1
  5
  1  0  0  6  2
       2306.70000000          0.00539400          0.00000000
        347.15000000          0.04024800         -0.00031692
         78.89000000          0.17921000         -0.00259440
         21.87600000          0.45978000         -0.03624100
          6.66460000          0.45234000         -0.08779000
          1.06690000          0.00000000          0.53320000
  1  0  0  1  1
          0.30700000          1.00000000
  1  1  1  3  1
         17.02200000          0.04891900
          3.68380000          0.24962000
          0.99234000          0.51347000
  1  1  1  1  1
          0.24487000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# FLUORINE
F  pc-1
  5
  1  0  0  6  2
       2954.60000000          0.00533370          0.00000000
        444.62000000          0.03982700         -0.00032962
        101.05000000          0.17802000         -0.00260830
         28.06800000          0.45917000         -0.03715000
          8.58370000          0.45352000         -0.08817800
          1.39860000          0.00000000          0.53135000
  1  0  0  1  1
          0.39969000          1.00000000
  1  1  1  3  1
         21.88300000          0.05024400
          4.77690000          0.25424000
          1.28230000          0.51220000
  1  1  1  1  1
          0.31127000          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
# NEON
Ne pc-1
  5
  1  0  0  6  2
       3680.10000000          0.00264540          0.00000000
        553.75000000          0.01976300         -0.00017209
        125.87000000          0.08859000         -0.00130160
         35.01300000          0.22936000         -0.01898000
         10.73900000          0.22717000         -0.04400800
          1.76930000          0.00000000          0.26525000
  1  0  0  1  1
          0.50149000          1.00000000
  1  1  1  3  1
         27.50200000          0.02547700
          6.03970000          0.12855000
          1.61900000          0.25586000
  1  1  1  1  1
          0.38970000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# SODIUM
Na pc-1
  4
  1  0  0 10  3
      23207.00000000          0.00068100          0.00000000          0.00000000
       3481.60000000          0.00525120         -0.00002932          0.00000000
        792.72000000          0.02684500         -0.00003220         -0.00000132
        224.59000000          0.10188000         -0.00214850         -0.00001438
         73.08800000          0.27784000         -0.00931570         -0.00013687
         26.19000000          0.44489000         -0.06707100         -0.00048799
          9.86610000          0.28206000         -0.05678900         -0.00028773
          2.21550000          0.02068500          0.53608000         -0.01017800
          0.68590000          0.00000000          0.59788000         -0.11118000
          0.07033700          0.00000000          0.00000000          0.59314000
  1  0  0  1  1
          0.02607500          1.00000000
  1  1  1  6  1
        135.55000000          0.00617590
         31.56200000          0.04531500
          9.67740000          0.17332000
          3.36910000          0.36867000
          1.17030000          0.43998000
          0.37651000          0.22613000
  1  1  1  1  1
          0.07500000          1.00000000
# MAGNESIUM
Mg pc-1
  4
  1  0  0 10  3
      28706.00000000          0.00032513          0.00000000          0.00000000
       4306.60000000          0.00250760         -0.00001306          0.00000000
        980.54000000          0.01283700         -0.00001798          0.00000116
        277.76000000          0.04896400         -0.00100360          0.00001351
         90.38600000          0.13517000         -0.00468190          0.00013542
         32.37400000          0.22193000         -0.03305100          0.00075360
         12.17700000          0.14657000         -0.03271800          0.00150980
          2.81660000          0.01198000          0.26039000         -0.01906800
          0.92173000          0.00000000          0.30808000         -0.07524100
          0.12709000          0.00000000          0.00000000          0.27161000
  1  0  0  1  1
          0.04608000          1.00000000
  1  1  1  6  1
        177.60000000          0.00282590
         41.44200000          0.02110300
         12.81800000          0.08266600
          4.51740000          0.18285000
          1.61280000          0.22357000
          0.54531000          0.10869000
  1  1  1  1  1
          0.13500000          1.00000000
# ALUMINUM
Al pc-1
  5
  1  0  0 10  3
      34702.00000000          0.00062778          0.00000000          0.00000000
       5205.90000000          0.00484320         -0.00002388          0.00000000
       1185.20000000          0.02481700         -0.00003937          0.00000451
        335.70000000          0.09502800         -0.00191680          0.00005323
        109.23000000          0.26474000         -0.00943620          0.00053333
         39.12000000          0.44274000         -0.06573900          0.00287540
         14.70900000          0.30134000         -0.07223200          0.00567340
          3.48960000          0.02681700          0.50924000         -0.05813300
          1.19360000          0.00000000          0.62972000         -0.18753000
          0.19585000          0.00000000          0.00000000          0.58570000
  1  0  0  1  1
          0.07143900          1.00000000
  1  1  1  7  2
        254.36000000          0.00429030          0.00000000
         59.51400000          0.03305500          0.00010756
         18.70800000          0.13486000         -0.00081981
          6.73620000          0.32836000         -0.00142160
          2.50450000          0.44798000         -0.01493000
          0.90820000          0.27040000          0.04377900
          0.20909000          0.00000000          0.49039000
  1  1  1  1  1
          0.05699000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
# SILICON
Si pc-1
  5
  1  0  0 10  3
      41263.00000000          0.00060948          0.00000000          0.00000000
       6189.60000000          0.00470400         -0.00002246          0.00000000
       1408.70000000          0.02413600         -0.00004176          0.00000603
        398.77000000          0.09276200         -0.00185700          0.00007428
        129.69000000          0.26047000         -0.00951130          0.00074023
         46.42500000          0.44181000         -0.06580000          0.00401070
         17.45500000          0.30755000         -0.07754600          0.00801370
          4.22220000          0.02919700          0.50303000         -0.07409100
          1.49330000          0.00000000          0.63824000         -0.21382000
          0.27174000          0.00000000          0.00000000          0.61263000
  1  0  0  1  1
          0.09850200          1.00000000
  1  1  1  7  2
        310.73000000          0.00411980          0.00000000
         72.82300000          0.03198100          0.00012637
         22.98500000          0.13224000         -0.00102520
          8.32130000          0.32779000         -0.00213370
          3.13530000          0.45107000         -0.01877400
          1.16930000          0.26345000          0.05752800
          0.29281000          0.00000000          0.53571000
  1  1  1  1  1
          0.08270400          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# PHOSPHOROUS
P  pc-1
  5
  1  0  0 10  3
      48073.00000000          0.00059919          0.00000000          0.00000000
       7211.40000000          0.00462410         -0.00002131          0.00000000
       1641.70000000          0.02372400         -0.00004422          0.00000713
        464.92000000          0.09130300         -0.00182210          0.00008450
        151.28000000          0.25750000         -0.00963660          0.00085919
         54.18900000          0.44080000         -0.06607200          0.00464780
         20.39700000          0.31175000         -0.08182400          0.00958110
          5.02410000          0.03111800          0.49850000         -0.08406600
          1.82460000          0.00000000          0.64492000         -0.23124000
          0.35871000          0.00000000          0.00000000          0.62350000
  1  0  0  1  1
          0.12887000          1.00000000
  1  1  1  7  2
        366.24000000          0.00409770          0.00000000
         85.93100000          0.03195600          0.00012506
         27.17200000          0.13326000         -0.00121660
          9.86850000          0.33228000         -0.00318130
          3.75330000          0.45335000         -0.02147500
          1.43020000          0.25058000          0.06999100
          0.38653000          0.00000000          0.56081000
  1  1  1  1  1
          0.11146000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
# SULFUR
S  pc-1
  5
  1  0  0 10  3
      55510.00000000          0.00058899          0.00000000          0.00000000
       8326.70000000          0.00454600         -0.00002048          0.00000000
       1895.60000000          0.02333500         -0.00004543          0.00000835
        536.77000000          0.08996500         -0.00179370          0.00009831
        174.67000000          0.25486000         -0.00972520          0.00100400
         62.57800000          0.43998000         -0.06639900          0.00544090
         23.57300000          0.31549000         -0.08550200          0.01140000
          5.89080000          0.03282600          0.49588000         -0.09513400
          2.18520000          0.00000000          0.64988000         -0.24735000
          0.45282000          0.00000000          0.00000000          0.63973000
  1  0  0  1  1
          0.16202000          1.00000000
  1  1  1  7  2
        395.45000000          0.00462660          0.00000000
         92.83400000          0.03589800          0.00010934
         29.26600000          0.14854000         -0.00163580
         10.59500000          0.35878000         -0.00506320
          4.02720000          0.45417000         -0.02396000
          1.54840000          0.20545000          0.10388000
          0.46134000          0.00000000          0.58063000
  1  1  1  1  1
          0.13131000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# CHLORINE
Cl pc-1
  5
  1  0  0 10  3
      63474.00000000          0.00058028          0.00000000          0.00000000
       9521.30000000          0.00447920         -0.00001982          0.00000000
       2167.40000000          0.02300000         -0.00004720          0.00000906
        613.74000000          0.08881500         -0.00177130          0.00010695
        199.72000000          0.25258000         -0.00980680          0.00109810
         71.56400000          0.43921000         -0.06671900          0.00598980
         26.97900000          0.31868000         -0.08871100          0.01276200
          6.82600000          0.03434800          0.49396000         -0.10307000
          2.57670000          0.00000000          0.65392000         -0.25941000
          0.55752000          0.00000000          0.00000000          0.64899000
  1  0  0  1  1
          0.19825000          1.00000000
  1  1  1  7  2
        413.12000000          0.00542510          0.00000000
         97.05400000          0.04164400         -0.00000174
         30.48200000          0.16990000         -0.00214410
         10.96200000          0.39275000         -0.00912980
          4.12760000          0.45045000         -0.01990600
          1.53380000          0.15308000          0.15582000
          0.51439000          0.00000000          0.58772000
  1  1  1  1  1
          0.15026000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
# ARGON
Ar pc-1
  5
  1  0  0 10  3
      71956.00000000          0.00028643          0.00000000          0.00000000
      10793.00000000          0.00221120         -0.00000961          0.00000000
       2457.00000000          0.01135800         -0.00002414          0.00000479
        695.72000000          0.04391600         -0.00087570          0.00005758
        226.40000000          0.12531000         -0.00493760          0.00058972
         81.13800000          0.21927000         -0.03351200          0.00323990
         30.61200000          0.16071000         -0.04576400          0.00698140
          7.82910000          0.01784900          0.24633000         -0.05491800
          2.99870000          0.00000000          0.32863000         -0.13472000
          0.67242000          0.00000000          0.00000000          0.32734000
  1  0  0  1  1
          0.23719000          1.00000000
  1  1  1  7  2
        446.27000000          0.00296130          0.00000000
        104.94000000          0.02259100         -0.00006082
         32.93100000          0.09152400         -0.00126610
         11.80900000          0.20642000         -0.00645890
          4.43040000          0.22195000         -0.00651050
          1.57510000          0.06276500          0.10436000
          0.56412000          0.00000000          0.29184000
  1  1  1  1  1
          0.17015000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# pc-2  EMSL  Basis Set Exchange Library  6/6/08 12:13 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
#
# HYDROGEN
H  pc-2
  6
  1  0  0  4  1
         75.42300000          0.00240650
         11.35000000          0.01848700
          2.59930000          0.08974200
          0.73513000          0.28111000
  1  0  0  1  1
          0.23167000          1.00000000
  1  0  0  1  1
          0.07414700          1.00000000
  1  1  1  1  1
          1.60000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          1.25000000          1.00000000
# HELIUM
He pc-2
  6
  1  0  0  4  1
        221.77000000          0.00144090
         33.37500000          0.01089400
          7.61140000          0.05018900
          2.10890000          0.14290000
  1  0  0  1  1
          0.62878000          1.00000000
  1  0  0  1  1
          0.18469000          1.00000000
  1  1  1  1  1
          2.40000000          1.00000000
  1  1  1  1  1
          0.68000000          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
# LITHIUM
Li pc-2
  6
  1  0  0  8  2
       1502.50000000          0.00076137          0.00000000
        225.51000000          0.00587120          0.00002104
         51.37500000          0.02974300         -0.00012177
         14.54700000          0.10959000         -0.00010088
          4.66450000          0.28000000         -0.00844260
          1.60080000          0.44163000         -0.02439400
          0.55262000          0.29922000         -0.09071800
          0.10366000          0.00000000          0.30659000
  1  0  0  1  1
          0.04744200          1.00000000
  1  0  0  1  1
          0.01979000          1.00000000
  1  1  1  3  1
          5.30000000          0.00554503
          1.15000000          0.05509120
          0.29000000          0.08756150
  1  1  1  1  1
          0.09000000          1.00000000
  1  2  2  1  1
          0.26000000          1.00000000
# BERYLLIUM
Be pc-2
  6
  1  0  0  8  2
       3067.30000000          0.00032683          0.00000000
        460.24000000          0.00252340          0.00000139
        104.80000000          0.01286700         -0.00003643
         29.65700000          0.04860700         -0.00033196
          9.53650000          0.13111000         -0.00366180
          3.31060000          0.22124000         -0.01754000
          1.18040000          0.16345000         -0.04090500
          0.26871000          0.00000000          0.11357000
  1  0  0  1  1
          0.11774000          1.00000000
  1  0  0  1  1
          0.04468500          1.00000000
  1  1  1  3  1
          8.24000000          0.01114710
          1.79000000          0.08054940
          0.45000000          0.25574400
  1  1  1  1  1
          0.14000000          1.00000000
  1  2  2  1  1
          0.39000000          1.00000000
# BORON
B  pc-2
  9
  1  0  0  8  2
       5220.40000000          0.00059530          0.00000000
        783.19000000          0.00459910          0.00000166
        178.31000000          0.02353000         -0.00006852
         50.46900000          0.09001500         -0.00068751
         16.28500000          0.24988000         -0.00736900
          5.68850000          0.44237000         -0.03709800
          2.04950000          0.34536000         -0.08698600
          0.51473000          0.00000000          0.21361000
  1  0  0  1  1
          0.21556000          1.00000000
  1  0  0  1  1
          0.07745700          1.00000000
  1  1  1  4  1
         21.81000000          0.00588410
          4.89300000          0.04179800
          1.39760000          0.15567000
          0.47747000          0.35997000
  1  1  1  1  1
          0.16419000          1.00000000
  1  1  1  1  1
          0.05400400          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.87000000          1.00000000
# CARBON
C  pc-2
  9
  1  0  0  8  2
       7857.10000000          0.00056825          0.00000000
       1178.70000000          0.00439150         -0.00000059
        268.32000000          0.02250400         -0.00006275
         75.94800000          0.08665300         -0.00075773
         24.55900000          0.24405000         -0.00733080
          8.62120000          0.44148000         -0.03893200
          3.12780000          0.35332000         -0.08890800
          0.82202000          0.00000000          0.21689000
  1  0  0  1  1
          0.33017000          1.00000000
  1  0  0  1  1
          0.11463000          1.00000000
  1  1  1  4  1
         33.77500000          0.00602940
          7.67660000          0.04322800
          2.23570000          0.16301000
          0.76447000          0.36504000
  1  1  1  1  1
          0.26232000          1.00000000
  1  1  1  1  1
          0.08463800          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
# NITROGEN
N  pc-2
  9
  1  0  0  8  2
      11101.00000000          0.00054570          0.00000000
       1665.30000000          0.00421810         -0.00000150
        379.08000000          0.02164500         -0.00005875
        107.30000000          0.08377600         -0.00077453
         34.74700000          0.23881000         -0.00721610
         12.24900000          0.43994000         -0.03933800
          4.47430000          0.36364000         -0.09061100
          1.24040000          0.00000000          0.19882000
  1  0  0  1  1
          0.48743000          1.00000000
  1  0  0  1  1
          0.16484000          1.00000000
  1  1  1  4  1
         47.93400000          0.00617060
         10.99900000          0.04426000
          3.24720000          0.16825000
          1.11140000          0.36848000
  1  1  1  1  1
          0.37988000          1.00000000
  1  1  1  1  1
          0.12068000          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  3  3  1  1
          1.02000000          1.00000000
# OXYGEN
O  pc-2
  9
  1  0  0  8  2
      14782.00000000          0.00053519          0.00000000
       2217.30000000          0.00413750         -0.00000193
        504.74000000          0.02124500         -0.00005796
        142.87000000          0.08245300         -0.00079494
         46.30000000          0.23671000         -0.00731250
         16.33700000          0.44039000         -0.04057400
          5.98280000          0.36465000         -0.09159400
          1.67180000          0.00000000          0.20940000
  1  0  0  1  1
          0.64662000          1.00000000
  1  0  0  1  1
          0.21669000          1.00000000
  1  1  1  4  1
         60.42400000          0.00689490
         13.93500000          0.04900500
          4.15310000          0.18255000
          1.41580000          0.37633000
  1  1  1  1  1
          0.47549000          1.00000000
  1  1  1  1  1
          0.14529000          1.00000000
  1  2  2  1  1
          2.20000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  3  3  1  1
          1.10000000          1.00000000
# FLUORINE
F  pc-2
  9
  1  0  0  8  2
      19127.00000000          0.00052250          0.00000000
       2868.90000000          0.00404000         -0.00000226
        653.04000000          0.02075900         -0.00005664
        184.85000000          0.08080000         -0.00079782
         59.94900000          0.23362000         -0.00727130
         21.19000000          0.43965000         -0.04083100
          7.78460000          0.37041000         -0.09293100
          2.23050000          0.00000000          0.20228000
  1  0  0  1  1
          0.85409000          1.00000000
  1  0  0  1  1
          0.28336000          1.00000000
  1  1  1  4  1
         77.63900000          0.00703130
         17.96500000          0.05013700
          5.40050000          0.18553000
          1.84230000          0.37546000
  1  1  1  1  1
          0.61532000          1.00000000
  1  1  1  1  1
          0.18489000          1.00000000
  1  2  2  1  1
          2.80000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
# NEON
Ne pc-2
  9
  1  0  0  8  2
      23880.00000000          0.00025835          0.00000000
       3581.70000000          0.00199770         -0.00000765
        815.27000000          0.01026900         -0.00013638
        230.77000000          0.04003600         -0.00206690
         74.88400000          0.11619000         -0.01814000
         26.51800000          0.21959000         -0.10379000
          9.76920000          0.18608000         -0.23283000
          2.83050000          0.00000000          0.50798000
  1  0  0  1  1
          1.07400000          1.00000000
  1  0  0  1  1
          0.35400000          1.00000000
  1  1  1  4  1
         97.10600000          0.00356680
         22.54300000          0.02546700
          6.81730000          0.09401600
          2.32630000          0.18796000
  1  1  1  1  1
          0.77425000          1.00000000
  1  1  1  1  1
          0.23026000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
  1  3  3  1  1
          1.30000000          1.00000000
# SODIUM
Na pc-2
  7
  1  0  0 11  3
      64474.00000000          0.00019020          0.00000000          0.00000000
       9667.50000000          0.00147490          0.00000000          0.00000000
       2200.80000000          0.00767780         -0.00001388          0.00000450
        623.26000000          0.03133300         -0.00014242          0.00005447
        203.12000000          0.10269000         -0.00181590          0.00061058
         72.94400000          0.25598000         -0.01209300          0.00417240
         28.02600000          0.41517000         -0.05682300          0.01823100
         11.05500000          0.30473000         -0.10110000          0.02901700
          3.54900000          0.04114600          0.22498000         -0.05293200
          1.40820000          0.00000000          0.51711000          0.16965000
          0.51148000          0.00000000          0.00000000          0.88478000
  1  0  0  1  1
          0.06953400          1.00000000
  1  0  0  1  1
          0.02512000          1.00000000
  1  1  1  7  1
        230.53000000          0.00254200
         54.20100000          0.01976800
         17.40200000          0.08348000
          6.31520000          0.23282000
          2.40840000          0.38216000
          0.90249000          0.37985000
          0.31450000          0.16287000
  1  1  1  1  1
          0.12100000          1.00000000
  1  1  1  1  1
          0.03900000          1.00000000
  1  2  2  1  1
          0.24000000          1.00000000
# MAGNESIUM
Mg pc-2
  7
  1  0  0 11  3
      81017.00000000          0.00008905          0.00000000          0.00000000
      12143.00000000          0.00069088         -0.00000052          0.00000000
       2763.80000000          0.00359990         -0.00000408         -0.00001191
        782.58000000          0.01472100         -0.00008248         -0.00014781
        255.03000000          0.04857200         -0.00070727         -0.00168720
         91.62300000          0.12279000         -0.00549130         -0.01186400
         35.24500000          0.20506000         -0.02385900         -0.05598300
         13.96000000          0.15913000         -0.04982700         -0.11311000
          4.74220000          0.02509900          0.08349700          0.18789000
          1.92840000          0.00000000          0.19563000          0.71752000
          0.72424000          0.00000000          0.00000000          0.53956000
  1  0  0  1  1
          0.12353000          1.00000000
  1  0  0  1  1
          0.04303200          1.00000000
  1  1  1  7  1
        309.05000000          0.00111300
         72.89400000          0.00875690
         23.49400000          0.03825400
          8.56190000          0.11095000
          3.30680000          0.19174000
          1.26940000          0.19457000
          0.46106000          0.07820400
  1  1  1  1  1
          0.17700000          1.00000000
  1  1  1  1  1
          0.05700000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
# ALUMINUM
Al pc-2
  9
  1  0  0 11  3
      99741.00000000          0.00016809          0.00000000          0.00000000
      14949.00000000          0.00130410         -0.00000048          0.00000000
       3402.50000000          0.00679790         -0.00000205         -0.00000556
        963.53000000          0.02784000         -0.00005573         -0.00006905
        314.05000000          0.09235800         -0.00041853         -0.00079085
        112.88000000          0.23633000         -0.00348130         -0.00564140
         43.47400000          0.40484000         -0.01486400         -0.02728800
         17.29200000          0.32992000         -0.03401200         -0.05953800
          6.16220000          0.05852100          0.04389600          0.07239300
          2.52260000          0.00000000          0.11958000          0.41226000
          0.96874000          0.00000000          0.00000000          0.39165000
  1  0  0  1  1
          0.19251000          1.00000000
  1  0  0  1  1
          0.06781300          1.00000000
  1  1  1  8  2
        579.71000000          0.00105610          0.00000000
        137.54000000          0.00863350          0.00002967
         44.06700000          0.04322700         -0.00010593
         16.14800000          0.14168000         -0.00017370
          6.48880000          0.30352000         -0.00443150
          2.66320000          0.40389000         -0.00441340
          1.07920000          0.28642000         -0.00107230
          0.39771000          0.00000000          0.17650000
  1  1  1  1  1
          0.13475000          1.00000000
  1  1  1  1  1
          0.04218500          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.33000000          1.00000000
  1  3  3  1  1
          0.48000000          1.00000000
# SILICON
Si pc-2
  9
  1  0  0 11  3
     120040.00000000          0.00016075          0.00000000          0.00000000
      17991.00000000          0.00124720         -0.00000068          0.00000000
       4094.80000000          0.00650400         -0.00000211         -0.00000399
       1159.60000000          0.02666500         -0.00006916         -0.00005020
        378.00000000          0.08881600         -0.00048080         -0.00057553
        135.93000000          0.22932000         -0.00416940         -0.00415240
         52.41100000          0.40025000         -0.01767400         -0.02043700
         20.92700000          0.33828000         -0.04289100         -0.04699800
          7.71300000          0.06551200          0.04536800          0.04398600
          3.16040000          0.00000000          0.13904000          0.33957000
          1.23480000          0.00000000          0.00000000          0.35038000
  1  0  0  1  1
          0.26775000          1.00000000
  1  0  0  1  1
          0.09406700          1.00000000
  1  1  1  8  2
        677.13000000          0.00109250          0.00000000
        160.67000000          0.00896010          0.00000790
         51.58500000          0.04474400         -0.00013613
         18.94800000          0.14748000         -0.00090378
          7.61630000          0.31480000         -0.00558630
          3.13170000          0.41339000         -0.01014100
          1.27030000          0.26440000          0.01866100
          0.43332000          0.00000000          0.28890000
  1  1  1  1  1
          0.16088000          1.00000000
  1  1  1  1  1
          0.05488300          1.00000000
  1  2  2  1  1
          1.68000000          1.00000000
  1  2  2  1  1
          0.38000000          1.00000000
  1  3  3  1  1
          0.54000000          1.00000000
# PHOSPHOROUS
P  pc-2
  9
  1  0  0 11  3
     145680.00000000          0.00015016          0.00000000          0.00000000
      21836.00000000          0.00116500         -0.00000105          0.00000000
       4969.90000000          0.00607980         -0.00000168         -0.00000249
       1407.30000000          0.02496800         -0.00008760         -0.00003095
        458.78000000          0.08363700         -0.00052745         -0.00035776
        165.08000000          0.21863000         -0.00495750         -0.00261230
         63.74400000          0.39234000         -0.02053500         -0.01320400
         25.59800000          0.35038000         -0.05503000         -0.03284800
          9.93070000          0.07728700          0.04158300          0.01818200
          3.96860000          0.00000000          0.17029000          0.25722000
          1.55650000          0.00000000          0.00000000          0.30682000
  1  0  0  1  1
          0.35404000          1.00000000
  1  0  0  1  1
          0.12394000          1.00000000
  1  1  1  8  2
        826.23000000          0.00102250          0.00000000
        196.02000000          0.00844720          0.00000411
         62.95100000          0.04266400         -0.00015057
         23.22200000          0.14239000         -0.00111410
          9.38850000          0.31059000         -0.00649420
          3.89970000          0.41672000         -0.01246900
          1.60480000          0.26618000          0.02345800
          0.56053000          0.00000000          0.32270000
  1  1  1  1  1
          0.21175000          1.00000000
  1  1  1  1  1
          0.07348600          1.00000000
  1  2  2  1  1
          1.89000000          1.00000000
  1  2  2  1  1
          0.43000000          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
# SULFUR
S  pc-2
  9
  1  0  0 11  3
     172030.00000000          0.00014353          0.00000000          0.00000000
      25783.00000000          0.00111370         -0.00000119          0.00000000
       5868.20000000          0.00581430         -0.00000123         -0.00000220
       1661.70000000          0.02390300         -0.00009048         -0.00002837
        541.75000000          0.08035400         -0.00050105         -0.00032591
        195.01000000          0.21175000         -0.00495100         -0.00241310
         75.39600000          0.38664000         -0.02025200         -0.01235200
         30.40700000          0.35747000         -0.05738800         -0.03211900
         12.12100000          0.08613100          0.03484700          0.01161100
          4.77770000          0.00000000          0.16833000          0.25542000
          1.89060000          0.00000000          0.00000000          0.31384000
  1  0  0  1  1
          0.44686000          1.00000000
  1  0  0  1  1
          0.15621000          1.00000000
  1  1  1  8  2
        968.12000000          0.00100480          0.00000000
        229.70000000          0.00833130         -0.00000807
         73.83300000          0.04226000         -0.00016943
         27.31200000          0.14206000         -0.00152430
         11.07400000          0.31256000         -0.00719930
          4.63070000          0.41933000         -0.01611300
          1.92990000          0.25924000          0.03423400
          0.68783000          0.00000000          0.35518000
  1  1  1  1  1
          0.25663000          1.00000000
  1  1  1  1  1
          0.08725100          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  3  3  1  1
          0.66000000          1.00000000
# CHLORINE
Cl pc-2
  9
  1  0  0 11  3
     201150.00000000          0.00013753          0.00000000          0.00000000
      30146.00000000          0.00106710         -0.00000134          0.00000000
       6861.00000000          0.00557370         -0.00000095         -0.00000197
       1942.80000000          0.02293500         -0.00009465         -0.00002487
        633.42000000          0.07735400         -0.00048337         -0.00028967
        228.10000000          0.20534000         -0.00500090         -0.00215130
         88.28800000          0.38093000         -0.02023000         -0.01119500
         35.75000000          0.36361000         -0.06020900         -0.03018000
         14.57100000          0.09518200          0.02919500          0.00594560
          5.65800000          0.00000000          0.16993000          0.24702000
          2.25540000          0.00000000          0.00000000          0.31412000
  1  0  0  1  1
          0.54947000          1.00000000
  1  0  0  1  1
          0.19126000          1.00000000
  1  1  1  8  2
       1129.90000000          0.00097621          0.00000000
        268.06000000          0.00812600         -0.00001160
         86.22200000          0.04143300         -0.00018289
         31.97900000          0.14035000         -0.00171700
         13.00800000          0.31207000         -0.00789740
          5.47660000          0.42099000         -0.01823700
          2.30900000          0.25664000          0.04003500
          0.84601000          0.00000000          0.36717000
  1  1  1  1  1
          0.31659000          1.00000000
  1  1  1  1  1
          0.10716000          1.00000000
  1  2  2  1  1
          2.31000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  3  3  1  1
          0.72000000          1.00000000
# ARGON
Ar pc-2
  9
  1  0  0 11  3
     232510.00000000          0.00006626          0.00000000          0.00000000
      34844.00000000          0.00051412         -0.00000706          0.00000000
       7930.30000000          0.00268610         -0.00000242         -0.00000094
       2245.70000000          0.01106200         -0.00047564         -0.00001183
        732.22000000          0.03740800         -0.00227710         -0.00013817
        263.77000000          0.09992800         -0.02452700         -0.00103240
        102.19000000          0.18788000         -0.09819400         -0.00543290
         41.52500000          0.18427000         -0.30459000         -0.01508500
         17.20200000          0.05178200          0.11940000          0.00111200
          6.59670000          0.00000000          0.83173000          0.12461000
          2.64770000          0.00000000          0.00000000          0.16083000
  1  0  0  1  1
          0.66193000          1.00000000
  1  0  0  1  1
          0.22901000          1.00000000
  1  1  1  8  2
       1297.70000000          0.00047997          0.00000000
        307.86000000          0.00400670         -0.00000664
         99.09600000          0.02049700         -0.00009881
         36.83700000          0.06981900         -0.00093571
         15.02700000          0.15625000         -0.00431330
          6.36620000          0.21099000         -0.00986480
          2.71100000          0.12665000          0.02233400
          1.01820000          0.00000000          0.18833000
  1  1  1  1  1
          0.38274000          1.00000000
  1  1  1  1  1
          0.12946000          1.00000000
  1  2  2  1  1
          2.52000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  3  3  1  1
          0.78000000          1.00000000
#  pc-3  EMSL  Basis Set Exchange Library  6/6/08 12:13 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
#
# HYDROGEN
H  pc-3
 12
  1  0  0  5  1
        774.69000000          0.00131630
        116.16000000          0.01022600
         26.44900000          0.05362900
          7.50150000          0.22285000
          2.45680000          0.75374000
  1  0  0  1  1
          0.88774000          1.00000000
  1  0  0  1  1
          0.34085000          1.00000000
  1  0  0  1  1
          0.13477000          1.00000000
  1  0  0  1  1
          0.05226300          1.00000000
  1  1  1  1  1
          6.50000000          1.00000000
  1  1  1  1  1
          1.55000000          1.00000000
  1  1  1  1  1
          0.55000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          1.95000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  3  3  1  1
          2.20000000          1.00000000
# HELIUM
He pc-3
 12
  1  0  0  5  1
       2167.40000000          0.00084153
        324.99000000          0.00652740
         73.99400000          0.03399500
         20.97500000          0.13811000
          6.84520000          0.44195000
  1  0  0  1  1
          2.43940000          1.00000000
  1  0  0  1  1
          0.90251000          1.00000000
  1  0  0  1  1
          0.33313000          1.00000000
  1  0  0  1  1
          0.12413000          1.00000000
  1  1  1  1  1
         10.70000000          1.00000000
  1  1  1  1  1
          2.55000000          1.00000000
  1  1  1  1  1
          0.90000000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.07000000          1.00000000
  1  3  3  1  1
          3.20000000          1.00000000
# LITHIUM
Li pc-3
 11
  1  0  0 10  2
      13018.00000000          0.00005145          0.00000000
       1950.10000000          0.00039716          0.00000153
        443.84000000          0.00210140         -0.00000310
        125.76000000          0.00864300          0.00005703
         41.09400000          0.03057700         -0.00003847
         14.88200000          0.08539700          0.00143160
          5.80750000          0.19415000          0.00164970
          2.38910000          0.28592000          0.02368500
          1.01840000          0.30530000          0.02024700
          0.44404000          0.00000000          0.10064000
  1  0  0  1  1
          0.19405000          1.00000000
  1  0  0  1  1
          0.08403900          1.00000000
  1  0  0  1  1
          0.03792100          1.00000000
  1  0  0  1  1
          0.01664000          1.00000000
  1  1  1  4  1
         15.40000000          0.00102953
          3.59000000          0.00833218
          1.09000000          0.02929890
          0.35000000          0.11954800
  1  1  1  1  1
          0.13000000          1.00000000
  1  1  1  1  1
          0.05000000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
# BERYLLIUM
Be pc-3
 11
  1  0  0 10  2
      26673.00000000          0.00002197          0.00000000
       3996.30000000          0.00016954          0.00000493
        909.67000000          0.00089757         -0.00000913
        257.77000000          0.00369380          0.00019440
         84.23400000          0.01314100          0.00000956
         30.54500000          0.03717900          0.00570280
         12.02000000          0.08599900          0.01234400
          5.04950000          0.13048000          0.10403000
          2.17190000          0.13871000          0.18882000
          0.93410000          0.00000000          0.42111000
  1  0  0  1  1
          0.38918000          1.00000000
  1  0  0  1  1
          0.17402000          1.00000000
  1  0  0  1  1
          0.07602800          1.00000000
  1  0  0  1  1
          0.03226500          1.00000000
  1  1  1  4  1
         27.80000000          0.00146992
          6.46000000          0.01290300
          1.96000000          0.04633670
          0.63000000          0.18363000
  1  1  1  1  1
          0.24000000          1.00000000
  1  1  1  1  1
          0.09000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          0.55000000          1.00000000
# BORON
B  pc-3
 17
  1  0  0 10  2
      57415.00000000          0.00002984          0.00000000
       8601.50000000          0.00023044          0.00000428
       1957.80000000          0.00121950         -0.00000707
        554.61000000          0.00504630          0.00017669
        181.05000000          0.01812300          0.00013538
         65.49100000          0.05331800          0.00601230
         25.59900000          0.13277000          0.01984700
         10.53200000          0.23069000          0.14467000
          4.44650000          0.25545000          0.39360000
          1.88320000          0.00000000          0.80698000
  1  0  0  1  1
          0.69831000          1.00000000
  1  0  0  1  1
          0.34310000          1.00000000
  1  0  0  1  1
          0.14276000          1.00000000
  1  0  0  1  1
          0.05815700          1.00000000
  1  1  1  5  1
         90.11100000          0.00055817
         21.16500000          0.00455240
          6.56180000          0.02231300
          2.56460000          0.05947100
          1.05100000          0.16256000
  1  1  1  1  1
          0.45193000          1.00000000
  1  1  1  1  1
          0.19468000          1.00000000
  1  1  1  1  1
          0.08321200          1.00000000
  1  1  1  1  1
          0.03329700          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
  1  3  3  1  1
          0.52000000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
# CARBON
C  pc-3
 17
  1  0  0 10  2
      87141.00000000          0.00002818          0.00000000
      13052.00000000          0.00021819          0.00000259
       2970.60000000          0.00115110         -0.00000309
        841.46000000          0.00478590          0.00012247
        274.59000000          0.01713400          0.00025494
         99.21500000          0.05112000          0.00512540
         38.69400000          0.12805000          0.02195500
         15.91100000          0.22773000          0.14112000
          6.76680000          0.24758000          0.41303000
          2.89840000          0.00000000          0.82714000
  1  0  0  1  1
          1.12460000          1.00000000
  1  0  0  1  1
          0.51446000          1.00000000
  1  0  0  1  1
          0.21176000          1.00000000
  1  0  0  1  1
          0.08501700          1.00000000
  1  1  1  5  1
        148.24000000          0.00050756
         34.91200000          0.00421260
         10.89400000          0.02133500
          4.19340000          0.06232900
          1.71340000          0.16642000
  1  1  1  1  1
          0.73566000          1.00000000
  1  1  1  1  1
          0.31637000          1.00000000
  1  1  1  1  1
          0.13242000          1.00000000
  1  1  1  1  1
          0.05190100          1.00000000
  1  2  2  1  1
          5.20000000          1.00000000
  1  2  2  1  1
          1.35000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  3  3  1  1
          0.65000000          1.00000000
  1  4  4  1  1
          1.40000000          1.00000000
# NITROGEN
N  pc-3
 17
  1  0  0 10  2
     124550.00000000          0.00002667          0.00000000
      18656.00000000          0.00020684          0.00000141
       4245.10000000          0.00108930          0.00000000
       1202.10000000          0.00454630          0.00008144
        392.14000000          0.01623700          0.00032439
        141.58000000          0.04895700          0.00436210
         55.13600000          0.12317000          0.02283800
         22.64300000          0.22425000          0.13462000
          9.65660000          0.23876000          0.42501000
          4.16850000          0.00000000          0.82517000
  1  0  0  1  1
          1.66780000          1.00000000
  1  0  0  1  1
          0.74574000          1.00000000
  1  0  0  1  1
          0.30516000          1.00000000
  1  0  0  1  1
          0.12089000          1.00000000
  1  1  1  5  1
        218.29000000          0.00048281
         51.48800000          0.00404200
         16.13000000          0.02094600
          6.13070000          0.06475700
          2.50520000          0.17042000
  1  1  1  1  1
          1.07300000          1.00000000
  1  1  1  1  1
          0.45838000          1.00000000
  1  1  1  1  1
          0.18948000          1.00000000
  1  1  1  1  1
          0.07335900          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          1.65000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          1.80000000          1.00000000
  1  3  3  1  1
          0.77000000          1.00000000
  1  4  4  1  1
          1.50000000          1.00000000
# OXYGEN
O  pc-3
 17
  1  0  0 10  2
     164030.00000000          0.00002652          0.00000000
      24567.00000000          0.00020571          0.00000133
       5591.00000000          0.00108270          0.00000000
       1583.60000000          0.00451900          0.00008025
        516.67000000          0.01613500          0.00034512
        186.56000000          0.04871600          0.00444840
         72.69600000          0.12268000          0.02360100
         29.99200000          0.22189000          0.13861000
         12.89900000          0.23904000          0.42872000
          5.61350000          0.00000000          0.84873000
  1  0  0  1  1
          2.29860000          1.00000000
  1  0  0  1  1
          0.99980000          1.00000000
  1  0  0  1  1
          0.40746000          1.00000000
  1  0  0  1  1
          0.15922000          1.00000000
  1  1  1  5  1
        272.02000000          0.00054941
         64.24300000          0.00458340
         20.24900000          0.02357300
          7.64380000          0.07433800
          3.12320000          0.18755000
  1  1  1  1  1
          1.32510000          1.00000000
  1  1  1  1  1
          0.55551000          1.00000000
  1  1  1  1  1
          0.22229000          1.00000000
  1  1  1  1  1
          0.08401000          1.00000000
  1  2  2  1  1
          7.00000000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  4  4  1  1
          1.60000000          1.00000000
# FLUORINE
F  pc-3
 17
  1  0  0 10  2
     215660.00000000          0.00002538          0.00000000
      32299.00000000          0.00019693          0.00000102
       7350.40000000          0.00103600          0.00000000
       2081.80000000          0.00432940          0.00006810
        679.09000000          0.01546200          0.00034620
        245.10000000          0.04690300          0.00413970
         95.46200000          0.11881000          0.02307300
         39.42200000          0.21711000          0.13395000
         17.01800000          0.23699000          0.42246000
          7.45250000          0.00000000          0.85999000
  1  0  0  1  1
          3.13290000          1.00000000
  1  0  0  1  1
          1.33950000          1.00000000
  1  0  0  1  1
          0.54218000          1.00000000
  1  0  0  1  1
          0.20904000          1.00000000
  1  1  1  5  1
        351.22000000          0.00055263
         82.97800000          0.00462850
         26.26700000          0.02380200
          9.93070000          0.07626200
          4.06700000          0.18964000
  1  1  1  1  1
          1.72460000          1.00000000
  1  1  1  1  1
          0.71976000          1.00000000
  1  1  1  1  1
          0.28624000          1.00000000
  1  1  1  1  1
          0.10789000          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.05000000          1.00000000
  1  4  4  1  1
          1.70000000          1.00000000
# NEON
Ne pc-3
 17
  1  0  0 10  2
     270660.00000000          0.00001247          0.00000000
      40541.00000000          0.00009678          0.00000000
       9226.50000000          0.00050863          0.00000065
       2613.20000000          0.00212860          0.00002741
        852.39000000          0.00759220          0.00018661
        307.61000000          0.02311600          0.00194920
        119.76000000          0.05861400          0.01177300
         49.43700000          0.10807000          0.06614600
         21.36900000          0.11660000          0.21457000
          9.39210000          0.00000000          0.42987000
  1  0  0  1  1
          3.98320000          1.00000000
  1  0  0  1  1
          1.68870000          1.00000000
  1  0  0  1  1
          0.68030000          1.00000000
  1  0  0  1  1
          0.26024000          1.00000000
  1  1  1  5  1
        443.45000000          0.00274680
        104.82000000          0.02308100
         33.25500000          0.11930000
         12.54800000          0.38863000
          5.14210000          0.95790000
  1  1  1  1  1
          2.17830000          1.00000000
  1  1  1  1  1
          0.90645000          1.00000000
  1  1  1  1  1
          0.35994000          1.00000000
  1  1  1  1  1
          0.13515000          1.00000000
  1  2  2  1  1
         10.00000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.15000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  3  3  1  1
          2.80000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
# SODIUM
Na pc-3
 11
  1  0  0 14  3
     421840.00000000          0.00001821          0.00000000          0.00000000
      63188.00000000          0.00014153          0.00000000          0.00000000
      14381.00000000          0.00074380          0.00000000          0.00000000
       4073.70000000          0.00312730         -0.00000659          0.00000000
       1329.10000000          0.01124900         -0.00001064         -0.00000126
        479.99000000          0.03529200         -0.00026565         -0.00001103
        187.36000000          0.09539000         -0.00112860         -0.00007692
         77.77000000          0.21001000         -0.00804960         -0.00043274
         33.79900000          0.34417000         -0.02603700         -0.00169970
         15.12700000          0.32701000         -0.07062200         -0.00435420
          6.93200000          0.12122000         -0.01221700         -0.00178400
          2.76510000          0.00644090          0.26047000          0.02523700
          1.13970000          0.00000000          0.35925000          0.07668600
          0.45213000          0.00000000          0.00000000          0.11132000
  1  0  0  1  1
          0.08260300          1.00000000
  1  0  0  1  1
          0.04151000          1.00000000
  1  0  0  1  1
          0.01861800          1.00000000
  1  1  1  9  1
       1156.80000000          0.00015835
        274.42000000          0.00137160
         89.13900000          0.00740860
         33.25900000          0.03121400
         13.55700000          0.09092000
          5.96240000          0.20137000
          2.68240000          0.30732000
          1.19710000          0.33347000
          0.51789000          0.22947000
  1  1  1  1  1
          0.21331000          1.00000000
  1  1  1  1  1
          0.10000000          1.00000000
  1  1  1  1  1
          0.03700000          1.00000000
  1  2  2  1  1
          0.91000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  3  3  1  1
          0.27000000          1.00000000
# MAGNESIUM
Mg pc-3
 11
  1  0  0 14  3
     564790.00000000          0.00000788          0.00000000          0.00000000
      84589.00000000          0.00006122          0.00000000          0.00000000
      19251.00000000          0.00032179          0.00000000          0.00000000
       5452.80000000          0.00135380         -0.00000299          0.00000000
       1779.10000000          0.00487800         -0.00000639          0.00000380
        642.58000000          0.01537600         -0.00013096          0.00003105
        250.92000000          0.04208100         -0.00060781          0.00022284
        104.19000000          0.09518700         -0.00421360          0.00120920
         45.27500000          0.16414000         -0.01490900          0.00476660
         20.31800000          0.17119000         -0.04186800          0.01026900
          9.33190000          0.07662600         -0.02166700          0.00471000
          3.69780000          0.00637870          0.14599000         -0.01339800
          1.57250000          0.00000000          0.20166000          0.23482000
          0.64949000          0.00000000          0.00000000          0.48791000
  1  0  0  1  1
          0.15901000          1.00000000
  1  0  0  1  1
          0.07166500          1.00000000
  1  0  0  1  1
          0.02994200          1.00000000
  1  1  1  9  1
       1516.90000000          0.00007161
        359.79000000          0.00062314
        116.76000000          0.00341360
         43.58000000          0.01453100
         17.92600000          0.04287000
          7.93560000          0.09778900
          3.60380000          0.15457000
          1.64410000          0.16828000
          0.74112000          0.11333000
  1  1  1  1  1
          0.31666000          1.00000000
  1  1  1  1  1
          0.14900000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          0.33000000          1.00000000
# ALUMINUM
Al pc-3
 15
  1  0  0 14  3
     721490.00000000          0.00001419          0.00000000          0.00000000
     108090.00000000          0.00011026          0.00000000          0.00000000
      24605.00000000          0.00057946          0.00000000          0.00000000
       6971.40000000          0.00243790         -0.00000493          0.00000000
       2274.90000000          0.00879450         -0.00000863         -0.00000016
        821.60000000          0.02782100         -0.00020373         -0.00000132
        320.78000000          0.07681600         -0.00091455         -0.00000982
        133.15000000          0.17710000         -0.00657840         -0.00006244
         57.81700000          0.31603000         -0.02395500         -0.00030825
         25.95400000          0.35108000         -0.07103100         -0.00125880
         11.89900000          0.17619000         -0.05045400         -0.00186120
          4.74990000          0.01826800          0.22311000          0.01120900
          2.06880000          0.00000000          0.34708000          0.08354100
          0.87779000          0.00000000          0.00000000          0.13466000
  1  0  0  1  1
          0.24951000          1.00000000
  1  0  0  1  1
          0.11462000          1.00000000
  1  0  0  1  1
          0.04819300          1.00000000
  1  1  1 10  2
       2019.70000000          0.00012156          0.00000000
        478.63000000          0.00106070          0.00005424
        155.02000000          0.00593650         -0.00003765
         57.90400000          0.02538200          0.00089364
         24.14000000          0.07618800         -0.00359030
         10.78900000          0.17997000         -0.00368970
          4.97300000          0.30275000         -0.05406900
          2.31610000          0.34478000         -0.03337300
          1.07910000          0.23763000          0.00454730
          0.49159000          0.00000000          0.87054000
  1  1  1  1  1
          0.20482000          1.00000000
  1  1  1  1  1
          0.07925600          1.00000000
  1  1  1  1  1
          0.02892800          1.00000000
  1  2  2  1  1
          5.60000000          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.44000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  3  3  1  1
          0.96000000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  4  4  1  1
          0.58000000          1.00000000
# SILICON
Si pc-3
 15
  1  0  0 14  3
     877450.00000000          0.00001340          0.00000000          0.00000000
     131450.00000000          0.00010407          0.00000000          0.00000000
      29929.00000000          0.00054678          0.00000000          0.00000000
       8480.20000000          0.00230100         -0.00000422          0.00000000
       2767.20000000          0.00830540         -0.00000634         -0.00000118
        999.40000000          0.02632200         -0.00016910         -0.00001035
        390.14000000          0.07303300         -0.00073715         -0.00007432
        161.91000000          0.17010000         -0.00544610         -0.00043713
         70.30400000          0.30891000         -0.02001000         -0.00193740
         31.57900000          0.35473000         -0.06137300         -0.00585630
         14.48000000          0.18872000         -0.04900200         -0.00683610
          5.83830000          0.02195300          0.17627000          0.02787000
          2.59460000          0.00000000          0.30080000          0.12767000
          1.12500000          0.00000000          0.00000000          0.17422000
  1  0  0  1  1
          0.35356000          1.00000000
  1  0  0  1  1
          0.16160000          1.00000000
  1  0  0  1  1
          0.06726100          1.00000000
  1  1  1 10  2
       2303.10000000          0.00013105          0.00000000
        545.84000000          0.00114650          0.00000612
        177.05000000          0.00636520         -0.00000590
         66.37700000          0.02719700          0.00008645
         27.60100000          0.08192500         -0.00053049
         12.34300000          0.19147000         -0.00089038
          5.68940000          0.31583000         -0.00798250
          2.64060000          0.35183000         -0.00376310
          1.20940000          0.21292000          0.01078700
          0.52013000          0.00000000          0.18186000
  1  1  1  1  1
          0.23256000          1.00000000
  1  1  1  1  1
          0.09814100          1.00000000
  1  1  1  1  1
          0.03836000          1.00000000
  1  2  2  1  1
          6.66000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.38000000          1.00000000
  1  4  4  1  1
          0.65000000          1.00000000
# PHOSPHOROUS
P  pc-3
 15
  1  0  0 14  3
    1063700.00000000          0.00001251          0.00000000          0.00000000
     160000.00000000          0.00009667          0.00000000          0.00000000
      36513.00000000          0.00050682          0.00000000          0.00000000
      10359.00000000          0.00213100         -0.00000345          0.00000000
       3382.80000000          0.00769250         -0.00000534         -0.00000176
       1222.30000000          0.02442100         -0.00013814         -0.00001580
        477.30000000          0.06812200         -0.00060882         -0.00011353
        198.09000000          0.16069000         -0.00450640         -0.00067329
         85.99400000          0.29867000         -0.01707100         -0.00303140
         38.62700000          0.35878000         -0.05395400         -0.00922920
         17.68800000          0.20616000         -0.05149400         -0.01193600
          7.25510000          0.02738600          0.13758000          0.03572500
          3.26990000          0.00000000          0.27525000          0.15875000
          1.43130000          0.00000000          0.00000000          0.21236000
  1  0  0  1  1
          0.47047000          1.00000000
  1  0  0  1  1
          0.21289000          1.00000000
  1  0  0  1  1
          0.08774200          1.00000000
  1  1  1 10  2
       2762.20000000          0.00012618          0.00000000
        654.78000000          0.00110480          0.00000596
        212.58000000          0.00614830         -0.00000681
         79.89500000          0.02630700          0.00007451
         33.36600000          0.07986600         -0.00060664
         14.98600000          0.18840000         -0.00126040
          6.96800000          0.31362000         -0.00947190
          3.28180000          0.35326000         -0.00440140
          1.52470000          0.21366000          0.01246600
          0.66924000          0.00000000          0.21343000
  1  1  1  1  1
          0.29929000          1.00000000
  1  1  1  1  1
          0.12811000          1.00000000
  1  1  1  1  1
          0.05099200          1.00000000
  1  2  2  1  1
          7.71000000          1.00000000
  1  2  2  1  1
          2.03000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          0.22000000          1.00000000
  1  3  3  1  1
          1.34000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  4  4  1  1
          0.72000000          1.00000000
# SULFUR
S  pc-3
 15
  1  0  0 14  3
    1250400.00000000          0.00001202          0.00000000          0.00000000
     188080.00000000          0.00009294          0.00000000          0.00000000
      42918.00000000          0.00048720          0.00000000          0.00000000
      12179.00000000          0.00204790         -0.00000304          0.00000000
       3978.70000000          0.00738970         -0.00000465         -0.00000231
       1438.10000000          0.02348100         -0.00012316         -0.00001956
        561.67000000          0.06568500         -0.00054723         -0.00014386
        233.11000000          0.15597000         -0.00407020         -0.00084419
        101.22000000          0.29322000         -0.01565200         -0.00386210
         45.49300000          0.36011000         -0.05030900         -0.01181300
         20.84700000          0.21506000         -0.05151700         -0.01611400
          8.64920000          0.03078200          0.11823000          0.04149200
          3.94560000          0.00000000          0.25628000          0.18517000
          1.74720000          0.00000000          0.00000000          0.23963000
  1  0  0  1  1
          0.59953000          1.00000000
  1  0  0  1  1
          0.27127000          1.00000000
  1  0  0  1  1
          0.11080000          1.00000000
  1  1  1 10  2
       3285.80000000          0.00012062          0.00000000
        778.93000000          0.00105870          0.00000424
        252.76000000          0.00591910         -0.00000743
         95.10000000          0.02540500          0.00002773
         39.82000000          0.07785900         -0.00065028
         17.92500000          0.18578000         -0.00189330
          8.36990000          0.31347000         -0.01019100
          3.96550000          0.35718000         -0.00762910
          1.85400000          0.21179000          0.02103200
          0.81971000          0.00000000          0.24347000
  1  1  1  1  1
          0.36117000          1.00000000
  1  1  1  1  1
          0.15097000          1.00000000
  1  1  1  1  1
          0.05962000          1.00000000
  1  2  2  1  1
          8.76000000          1.00000000
  1  2  2  1  1
          2.30000000          1.00000000
  1  2  2  1  1
          0.68000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          1.53000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  4  4  1  1
          0.79000000          1.00000000
# CHLORINE
Cl pc-3
 15
  1  0  0 14  3
    1461100.00000000          0.00001153          0.00000000          0.00000000
     219590.00000000          0.00008923          0.00000000          0.00000000
      50085.00000000          0.00046811          0.00000000          0.00000000
      14206.00000000          0.00196920         -0.00000271          0.00000000
       4638.90000000          0.00711120         -0.00000432         -0.00000287
       1676.30000000          0.02262500         -0.00010907         -0.00002495
        654.51000000          0.06348800         -0.00048853         -0.00018272
        271.53000000          0.15173000         -0.00363270         -0.00108210
        117.87000000          0.28826000         -0.01414200         -0.00498460
         52.98400000          0.36113000         -0.04616700         -0.01541400
         24.29200000          0.22303000         -0.05010700         -0.02177400
         10.18400000          0.03403100          0.09999900          0.04888100
          4.69280000          0.00000000          0.23750000          0.21808000
          2.09740000          0.00000000          0.00000000          0.27412000
  1  0  0  1  1
          0.74867000          1.00000000
  1  0  0  1  1
          0.33613000          1.00000000
  1  0  0  1  1
          0.13573000          1.00000000
  1  1  1 10  2
       3845.70000000          0.00011653          0.00000000
        911.23000000          0.00102500          0.00000358
        295.64000000          0.00574810         -0.00000778
        111.40000000          0.02470000          0.00000677
         46.76700000          0.07626300         -0.00069394
         21.10600000          0.18343000         -0.00225630
          9.90580000          0.31219000         -0.01101800
          4.73470000          0.35836000         -0.00936630
          2.23640000          0.21176000          0.02517100
          1.00710000          0.00000000          0.25574000
  1  1  1  1  1
          0.44369000          1.00000000
  1  1  1  1  1
          0.18488000          1.00000000
  1  1  1  1  1
          0.07326800          1.00000000
  1  2  2  1  1
          9.81000000          1.00000000
  1  2  2  1  1
          2.58000000          1.00000000
  1  2  2  1  1
          0.76000000          1.00000000
  1  2  2  1  1
          0.28000000          1.00000000
  1  3  3  1  1
          1.72000000          1.00000000
  1  3  3  1  1
          0.57000000          1.00000000
  1  4  4  1  1
          0.86000000          1.00000000
# ARGON
Ar pc-3
 15
  1  0  0 14  3
    1702200.00000000          0.00000551          0.00000000          0.00000000
     254910.00000000          0.00004283          0.00000000          0.00000000
      58011.00000000          0.00022523          0.00000000          0.00000000
      16431.00000000          0.00094887         -0.00000120          0.00000000
       5360.50000000          0.00343160         -0.00000200         -0.00000162
       1935.40000000          0.01093900         -0.00004943         -0.00001423
        755.09000000          0.03079100         -0.00022448         -0.00010427
        313.08000000          0.07398700         -0.00166520         -0.00062078
        135.88000000          0.14187000         -0.00657890         -0.00288130
         61.09200000          0.18089000         -0.02173400         -0.00902010
         28.02400000          0.11508000         -0.02485100         -0.01322600
         11.86000000          0.01857900          0.04358600          0.02632900
          5.51170000          0.00000000          0.11336000          0.12105000
          2.48220000          0.00000000          0.00000000          0.15170000
  1  0  0  1  1
          0.91761000          1.00000000
  1  0  0  1  1
          0.40703000          1.00000000
  1  0  0  1  1
          0.16238000          1.00000000
  1  1  1 10  2
       4415.50000000          0.00005728          0.00000000
       1046.30000000          0.00050427          0.00000148
        339.54000000          0.00283210         -0.00000423
        128.10000000          0.01218600         -0.00000694
         53.82300000          0.03792400         -0.00037331
         24.30700000          0.09176200         -0.00132140
         11.44000000          0.15656000         -0.00599320
          5.51320000          0.17875000         -0.00517140
          2.63310000          0.10447000          0.01411000
          1.21090000          0.00000000          0.13276000
  1  1  1  1  1
          0.53411000          1.00000000
  1  1  1  1  1
          0.22314000          1.00000000
  1  1  1  1  1
          0.08879200          1.00000000
  1  2  2  1  1
         10.86000000          1.00000000
  1  2  2  1  1
          2.86000000          1.00000000
  1  2  2  1  1
          0.84000000          1.00000000
  1  2  2  1  1
          0.31000000          1.00000000
  1  3  3  1  1
          1.91000000          1.00000000
  1  3  3  1  1
          0.63000000          1.00000000
  1  4  4  1  1
          0.93000000          1.00000000
#  pc-4  EMSL  Basis Set Exchange Library  6/6/08 12:14 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 111 (44), 11198 -11204, 2007
#
# HYDROGEN
H  pc-4
 19
  1  0  0  5  1
       3079.70000000          0.00023473
        461.52000000          0.00182450
        105.06000000          0.00959330
         29.76400000          0.04046100
          9.71830000          0.14607000
  1  0  0  1  1
          3.51790000          1.00000000
  1  0  0  1  1
          1.37700000          1.00000000
  1  0  0  1  1
          0.56831000          1.00000000
  1  0  0  1  1
          0.24341000          1.00000000
  1  0  0  1  1
          0.10505000          1.00000000
  1  0  0  1  1
          0.04419800          1.00000000
  1  1  1  1  1
         30.00000000          1.00000000
  1  1  1  1  1
          6.60000000          1.00000000
  1  1  1  1  1
          2.10000000          1.00000000
  1  1  1  1  1
          0.95000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  1  1  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  4  4  1  1
          3.20000000          1.00000000
# HELIUM
He pc-4
 19
  1  0  0  5  1
       8780.20000000          0.00146640
       1315.60000000          0.01139500
        299.46000000          0.05981900
         84.83300000          0.25089000
         27.69100000          0.89135000
  1  0  0  1  1
         10.00800000          1.00000000
  1  0  0  1  1
          3.89240000          1.00000000
  1  0  0  1  1
          1.58190000          1.00000000
  1  0  0  1  1
          0.65698000          1.00000000
  1  0  0  1  1
          0.26459000          1.00000000
  1  0  0  1  1
          0.10585000          1.00000000
  1  1  1  1  1
         40.50000000          1.00000000
  1  1  1  1  1
          8.90000000          1.00000000
  1  1  1  1  1
          2.85000000          1.00000000
  1  1  1  1  1
          1.30000000          1.00000000
  1  1  1  1  1
          0.60000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          3.70000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          4.10000000          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  4  4  1  1
          4.65000000          1.00000000
# LITHIUM
Li pc-4
 17
  1  0  0 13  2
      70681.00000000          0.00000544          0.00000000
      13594.00000000          0.00003328         -0.00000011
       3100.40000000          0.00019175          0.00000017
        826.46000000          0.00089686         -0.00000357
        253.76000000          0.00344770          0.00000859
         88.45100000          0.01143500         -0.00005557
         34.49300000          0.03095700          0.00028213
         14.83100000          0.07323700         -0.00045594
          6.92990000          0.12668000          0.00524910
          3.46780000          0.21423000         -0.00487050
          1.83160000          0.17857000          0.04683100
          1.00630000          0.28492000         -0.03228200
          0.56678000          0.00000000          0.10296000
  1  0  0  1  1
          0.32254000          1.00000000
  1  0  0  1  1
          0.18277000          1.00000000
  1  0  0  1  1
          0.10164000          1.00000000
  1  0  0  1  1
          0.05466600          1.00000000
  1  0  0  1  1
          0.02802500          1.00000000
  1  0  0  1  1
          0.01349700          1.00000000
  1  1  1  5  1
         28.50000000          0.00036754
          6.64000000          0.00322359
          1.92000000          0.01432120
          0.77000000          0.03648140
          0.32000000          0.07577460
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.06600000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          0.20000000          1.00000000
  1  4  4  1  1
          0.55000000          1.00000000
# BERYLLIUM
Be pc-4
 17
  1  0  0 13  2
     139330.00000000          0.00000244          0.00000000
      26774.00000000          0.00001494         -0.00000040
       6112.00000000          0.00008580          0.00000060
       1632.90000000          0.00040022         -0.00001224
        503.03000000          0.00152890          0.00003235
        176.03000000          0.00505860         -0.00017006
         68.93900000          0.01364400          0.00113620
         29.76800000          0.03273000         -0.00064192
         13.96300000          0.05754600          0.02159000
          7.00900000          0.10067000          0.00042561
          3.70940000          0.08634800          0.18149000
          2.03920000          0.12653000          0.01235200
          1.14720000          0.00000000          0.38475000
  1  0  0  1  1
          0.65070000          1.00000000
  1  0  0  1  1
          0.36659000          1.00000000
  1  0  0  1  1
          0.20211000          1.00000000
  1  0  0  1  1
          0.10742000          1.00000000
  1  0  0  1  1
          0.05423100          1.00000000
  1  0  0  1  1
          0.02561900          1.00000000
  1  1  1  5  1
         45.70000000          0.00065877
         10.60000000          0.00573382
          3.08000000          0.02784590
          1.23000000          0.05643490
          0.51000000          0.17616700
  1  1  1  1  1
          0.23000000          1.00000000
  1  1  1  1  1
          0.10600000          1.00000000
  1  1  1  1  1
          0.04000000          1.00000000
  1  2  2  1  1
          3.35000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  2  2  1  1
          0.21000000          1.00000000
  1  3  3  1  1
          0.75000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          0.80000000          1.00000000
# BORON
B  pc-4
 26
  1  0  0 12  2
     742500.00000000          0.00000122          0.00000000
     110930.00000000          0.00000944          0.00000000
      25203.00000000          0.00005028          0.00000000
       7129.30000000          0.00020962          0.00000231
       2324.70000000          0.00077739         -0.00000366
        839.05000000          0.00247190          0.00004948
        327.79000000          0.00746650          0.00001943
        136.72000000          0.01909500          0.00110270
         60.29400000          0.04670600          0.00268300
         27.73100000          0.08501500          0.02218600
         12.99200000          0.14297000          0.06084500
          6.25510000          0.00000000          0.28114000
  1  0  0  1  1
          3.14720000          1.00000000
  1  0  0  1  1
          1.56270000          1.00000000
  1  0  0  1  1
          0.74066000          1.00000000
  1  0  0  1  1
          0.31290000          1.00000000
  1  0  0  1  1
          0.13142000          1.00000000
  1  0  0  1  1
          0.05470700          1.00000000
  1  1  1  5  1
        227.84000000          0.00112430
         53.92200000          0.00973930
         17.04800000          0.05453600
          6.00200000          0.23171000
          2.60660000          0.49931000
  1  1  1  1  1
          1.19620000          1.00000000
  1  1  1  1  1
          0.56967000          1.00000000
  1  1  1  1  1
          0.27377000          1.00000000
  1  1  1  1  1
          0.12880000          1.00000000
  1  1  1  1  1
          0.05965300          1.00000000
  1  1  1  1  1
          0.02619000          1.00000000
  1  2  2  1  1
          5.30000000          1.00000000
  1  2  2  1  1
          1.90000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  3  3  1  1
          1.90000000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          1.65000000          1.00000000
  1  4  4  1  1
          0.70000000          1.00000000
  1  5  5  1  1
          1.75000000          1.00000000
# CARBON
C  pc-4
 26
  1  0  0 12  2
     527780.00000000          0.00000297          0.00000000
      79105.00000000          0.00002316          0.00000000
      18006.00000000          0.00012089          0.00000036
       5100.80000000          0.00051490         -0.00000359
       1664.70000000          0.00184580          0.00001809
        601.66000000          0.00602860          0.00000125
        235.40000000          0.01702300          0.00071075
         98.26300000          0.04407700          0.00253460
         43.26900000          0.08906100          0.01993400
         19.85800000          0.14817000          0.06504700
          9.56920000          0.06143600          0.27000000
          4.93730000          0.00000000          0.32854000
  1  0  0  1  1
          2.66870000          1.00000000
  1  0  0  1  1
          1.46740000          1.00000000
  1  0  0  1  1
          0.63863000          1.00000000
  1  0  0  1  1
          0.30240000          1.00000000
  1  0  0  1  1
          0.14116000          1.00000000
  1  0  0  1  1
          0.06374900          1.00000000
  1  1  1  5  1
        382.21000000          0.00098484
         90.48900000          0.00858470
         28.87100000          0.04827200
         10.38500000          0.20454000
          4.49720000          0.49867000
  1  1  1  1  1
          2.02740000          1.00000000
  1  1  1  1  1
          0.95154000          1.00000000
  1  1  1  1  1
          0.44815000          1.00000000
  1  1  1  1  1
          0.20721000          1.00000000
  1  1  1  1  1
          0.09487000          1.00000000
  1  1  1  1  1
          0.04084300          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.40000000          1.00000000
  1  4  4  1  1
          2.10000000          1.00000000
  1  4  4  1  1
          0.90000000          1.00000000
  1  5  5  1  1
          1.85000000          1.00000000
# NITROGEN
N  pc-4
 26
  1  0  0 12  2
     894760.00000000          0.00000226          0.00000000
     134830.00000000          0.00001754          0.00000000
      30808.00000000          0.00009117          0.00000000
       8751.50000000          0.00038740         -0.00000321
       2862.00000000          0.00138700          0.00001370
       1035.30000000          0.00455030         -0.00001486
        404.73000000          0.01300900          0.00048102
        168.33000000          0.03469600          0.00153840
         73.69500000          0.07480400          0.01355500
         33.75300000          0.13457000          0.04731100
         16.15700000          0.11672000          0.20160000
          7.96880000          0.00000000          0.40713000
  1  0  0  1  1
          3.95210000          1.00000000
  1  0  0  1  1
          1.94540000          1.00000000
  1  0  0  1  1
          0.92929000          1.00000000
  1  0  0  1  1
          0.44085000          1.00000000
  1  0  0  1  1
          0.20340000          1.00000000
  1  0  0  1  1
          0.09122600          1.00000000
  1  1  1  5  1
        566.23000000          0.00092433
        134.10000000          0.00808980
         43.01300000          0.04546300
         15.61200000          0.19622000
          6.64270000          0.51754000
  1  1  1  1  1
          2.97480000          1.00000000
  1  1  1  1  1
          1.38850000          1.00000000
  1  1  1  1  1
          0.65012000          1.00000000
  1  1  1  1  1
          0.30028000          1.00000000
  1  1  1  1  1
          0.13620000          1.00000000
  1  1  1  1  1
          0.05784500          1.00000000
  1  2  2  1  1
         12.80000000          1.00000000
  1  2  2  1  1
          4.40000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.37000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  3  3  1  1
          2.30000000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  4  4  1  1
          2.55000000          1.00000000
  1  4  4  1  1
          1.10000000          1.00000000
  1  5  5  1  1
          1.95000000          1.00000000
# OXYGEN
O  pc-4
 26
  1  0  0 12  2
    1259700.00000000          0.00000207          0.00000000
     190110.00000000          0.00001596          0.00000000
      43449.00000000          0.00008333          0.00000000
      12342.00000000          0.00035212         -0.00000088
       4035.00000000          0.00127090          0.00000749
       1459.70000000          0.00413240          0.00001892
        570.66000000          0.01197000          0.00035166
        237.50000000          0.03156100          0.00170470
        104.11000000          0.06996000          0.01141200
         47.58100000          0.12702000          0.04602500
         22.54600000          0.11899000          0.19140000
         11.09300000          0.00000000          0.40260000
  1  0  0  1  1
          5.54090000          1.00000000
  1  0  0  1  1
          2.77940000          1.00000000
  1  0  0  1  1
          1.28370000          1.00000000
  1  0  0  1  1
          0.59649000          1.00000000
  1  0  0  1  1
          0.27057000          1.00000000
  1  0  0  1  1
          0.12028000          1.00000000
  1  1  1  5  1
        708.61000000          0.00104560
        167.86000000          0.00912920
         53.96700000          0.05097700
         19.80700000          0.21599000
          8.38320000          0.58777000
  1  1  1  1  1
          3.74470000          1.00000000
  1  1  1  1  1
          1.73220000          1.00000000
  1  1  1  1  1
          0.79977000          1.00000000
  1  1  1  1  1
          0.36323000          1.00000000
  1  1  1  1  1
          0.15963000          1.00000000
  1  1  1  1  1
          0.06566400          1.00000000
  1  2  2  1  1
         18.20000000          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  4  4  1  1
          3.05000000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
  1  5  5  1  1
          2.05000000          1.00000000
# FLUORINE
F  pc-4
 26
  1  0  0 12  2
    1856000.00000000          0.00000172          0.00000000
     280070.00000000          0.00001324          0.00000000
      64078.00000000          0.00006902          0.00000000
      18216.00000000          0.00029162         -0.00000081
       5957.80000000          0.00105220          0.00000585
       2155.00000000          0.00343010          0.00001118
        841.96000000          0.00997250          0.00026452
        349.82000000          0.02662500          0.00124470
        152.79000000          0.06039700          0.00880460
         69.36700000          0.11468000          0.03666600
         32.57400000          0.11487000          0.16212000
         15.88900000          0.00000000          0.37403000
  1  0  0  1  1
          7.86510000          1.00000000
  1  0  0  1  1
          3.91990000          1.00000000
  1  0  0  1  1
          1.78610000          1.00000000
  1  0  0  1  1
          0.82065000          1.00000000
  1  0  0  1  1
          0.36937000          1.00000000
  1  0  0  1  1
          0.16198000          1.00000000
  1  1  1  5  1
        917.89000000          0.00104500
        217.41000000          0.00914290
         69.93900000          0.05122700
         25.83100000          0.21558000
         10.96900000          0.59660000
  1  1  1  1  1
          4.92150000          1.00000000
  1  1  1  1  1
          2.28390000          1.00000000
  1  1  1  1  1
          1.05790000          1.00000000
  1  1  1  1  1
          0.48135000          1.00000000
  1  1  1  1  1
          0.20902000          1.00000000
  1  1  1  1  1
          0.08555600          1.00000000
  1  2  2  1  1
         25.50000000          1.00000000
  1  2  2  1  1
          8.00000000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.45000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  3  3  1  1
          3.10000000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
  1  4  4  1  1
          3.60000000          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  5  5  1  1
          2.15000000          1.00000000
# NEON
Ne pc-4
 26
  1  0  0 12  2
    2522600.00000000          0.00000767          0.00000000
     377060.00000000          0.00005983          0.00000000
      85713.00000000          0.00031441          0.00000000
      24261.00000000          0.00133260         -0.00000020
       7911.70000000          0.00483320          0.00000212
       2855.50000000          0.01576300          0.00000758
       1113.60000000          0.04612300          0.00011055
        461.89000000          0.12339000          0.00058283
        201.35000000          0.28428000          0.00387530
         91.19800000          0.54569000          0.01708600
         42.68000000          0.58141000          0.07497800
         20.74200000          0.00000000          0.18391000
  1  0  0  1  1
         10.24900000          1.00000000
  1  0  0  1  1
          5.10130000          1.00000000
  1  0  0  1  1
          2.30310000          1.00000000
  1  0  0  1  1
          1.05310000          1.00000000
  1  0  0  1  1
          0.47222000          1.00000000
  1  0  0  1  1
          0.20466000          1.00000000
  1  1  1  5  1
       1169.90000000          0.00051064
        277.11000000          0.00447380
         89.26400000          0.02511000
         33.10000000          0.10593000
         14.03100000          0.29958000
  1  1  1  1  1
          6.29850000          1.00000000
  1  1  1  1  1
          2.92340000          1.00000000
  1  1  1  1  1
          1.35370000          1.00000000
  1  1  1  1  1
          0.61362000          1.00000000
  1  1  1  1  1
          0.26362000          1.00000000
  1  1  1  1  1
          0.10755000          1.00000000
  1  2  2  1  1
         32.00000000          1.00000000
  1  2  2  1  1
         10.10000000          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.85000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          3.60000000          1.00000000
  1  3  3  1  1
          1.55000000          1.00000000
  1  3  3  1  1
          0.70000000          1.00000000
  1  4  4  1  1
          4.20000000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
  1  5  5  1  1
          2.25000000          1.00000000
# SODIUM
Na pc-4
 16
  1  0  0 17  3
    1918700.00000000          0.00000274          0.00000000          0.00000000
     287270.00000000          0.00002133          0.00000000          0.00000000
      65382.00000000          0.00011221          0.00000000          0.00000000
      18523.00000000          0.00047369          0.00000000          0.00000000
       6045.40000000          0.00172350          0.00000000         -0.00000144
       2184.20000000          0.00559140         -0.00001790         -0.00001306
        853.11000000          0.01646100         -0.00006498         -0.00009742
        354.69000000          0.04377600         -0.00060909         -0.00063787
        155.33000000          0.10266000         -0.00260940         -0.00333940
         71.23400000          0.20074000         -0.01329500         -0.01514500
         33.83500000          0.30952000         -0.03986700         -0.04907900
         16.34900000          0.30826000         -0.09610800         -0.10865000
          8.00820000          0.14855000         -0.07047900         -0.08852700
          3.67130000          0.01711300          0.24565000          0.29366000
          1.71180000         -0.00155410          0.55362000          0.47915000
          0.79147000          0.00000000          0.45869000          0.15680000
          0.35479000          0.00000000          0.00000000         -0.57853000
  1  0  0  1  1
          0.09066400          1.00000000
  1  0  0  1  1
          0.04431300          1.00000000
  1  0  0  1  1
          0.02194800          1.00000000
  1  0  0  1  1
          0.01082100          1.00000000
  1  1  1 11  1
       3044.20000000          0.00002935
        720.02000000          0.00026100
        234.42000000          0.00148190
         89.66600000          0.00648150
         36.69500000          0.02480300
         16.25600000          0.06595400
          7.65930000          0.14794000
          3.71250000          0.24400000
          1.79920000          0.30244000
          0.86288000          0.27557000
          0.40104000          0.16219000
  1  1  1  1  1
          0.17759000          1.00000000
  1  1  1  1  1
          0.08070000          1.00000000
  1  1  1  1  1
          0.03670000          1.00000000
  1  1  1  1  1
          0.01670000          1.00000000
  1  2  2  1  1
          2.35000000          1.00000000
  1  2  2  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          0.14000000          1.00000000
  1  3  3  1  1
          1.08000000          1.00000000
  1  3  3  1  1
          0.24000000          1.00000000
  1  4  4  1  1
          0.30000000          1.00000000
# MAGNESIUM
Mg pc-4
 16
  1  0  0 17  3
    3199100.00000000          0.00000090          0.00000000          0.00000000
     479000.00000000          0.00000701          0.00000000          0.00000000
     109010.00000000          0.00003689          0.00000000          0.00000000
      30878.00000000          0.00015584          0.00000000          0.00000000
      10075.00000000          0.00056784          0.00000000          0.00000000
       3637.90000000          0.00184930         -0.00000336          0.00000000
       1419.50000000          0.00548860         -0.00001119          0.00000139
        589.35000000          0.01487100         -0.00011126          0.00001097
        257.53000000          0.03631500         -0.00050000          0.00005638
        117.17000000          0.07751300         -0.00266410          0.00026010
         54.76200000          0.13593000         -0.00983480          0.00092696
         26.28800000          0.16490000         -0.02596400          0.00140020
         12.86000000          0.11240000         -0.03988900          0.00021032
          6.26040000          0.02650100          0.02928600         -0.00139360
          2.85140000          0.00006822          0.16700000          0.06338500
          1.30580000          0.00000000          0.15689000          0.35178000
          0.58331000          0.00000000          0.00000000          0.45980000
  1  0  0  1  1
          0.16849000          1.00000000
  1  0  0  1  1
          0.08564600          1.00000000
  1  0  0  1  1
          0.04507700          1.00000000
  1  0  0  1  1
          0.02193400          1.00000000
  1  1  1 11  1
       4157.80000000          0.00001234
        984.53000000          0.00010978
        320.09000000          0.00063086
        121.73000000          0.00283310
         49.89200000          0.01077300
         22.54200000          0.02877200
         10.74900000          0.06653700
          5.28990000          0.11557000
          2.59960000          0.15417000
          1.25180000          0.14665000
          0.59246000          0.08190400
  1  1  1  1  1
          0.26941000          1.00000000
  1  1  1  1  1
          0.12250000          1.00000000
  1  1  1  1  1
          0.05570000          1.00000000
  1  1  1  1  1
          0.02530000          1.00000000
  1  2  2  1  1
          3.36000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          0.35000000          1.00000000
# ALUMINUM
Al pc-4
 22
  1  0  0 17  3
    3845200.00000000          0.00000175          0.00000000          0.00000000
     575260.00000000          0.00001365          0.00000000          0.00000000
     130860.00000000          0.00007187          0.00000000          0.00000000
      37063.00000000          0.00030355          0.00000000          0.00000000
      12094.00000000          0.00110600          0.00000000         -0.00000109
       4366.80000000          0.00360350         -0.00001133         -0.00001050
       1703.60000000          0.01070200         -0.00006005         -0.00007868
        707.13000000          0.02903600         -0.00046344         -0.00052023
        308.97000000          0.07104500         -0.00237800         -0.00291520
        140.71000000          0.15195000         -0.01184200         -0.01384800
         65.91700000          0.26792000         -0.04567500         -0.05496800
         31.73000000          0.32914000         -0.11864000         -0.13850000
         15.58700000          0.22998000         -0.19088000         -0.22663000
          7.63820000          0.05743300          0.12421000          0.15454000
          3.54540000          0.00040260          0.72353000          0.75844000
          1.66790000          0.00000000          0.75665000          0.53134000
          0.76939000          0.00000000          0.00000000         -0.50362000
  1  0  0  1  1
          0.27917000          1.00000000
  1  0  0  1  1
          0.14016000          1.00000000
  1  0  0  1  1
          0.07033600          1.00000000
  1  0  0  1  1
          0.03366000          1.00000000
  1  1  1 12  2
       5687.30000000          0.00001998          0.00000000
       1345.20000000          0.00017728          0.00001010
        436.38000000          0.00103710          0.00000000
        165.45000000          0.00470060          0.00022858
         68.61900000          0.01742700         -0.00026528
         31.87500000          0.04664300          0.00155100
         15.43200000          0.11224000         -0.00904470
          7.75700000          0.20457000         -0.00361670
          3.92560000          0.29828000         -0.07048600
          1.97640000          0.30142000         -0.01171600
          0.99918000          0.18905000          0.04407300
          0.50630000          0.00000000          0.55310000
  1  1  1  1  1
          0.25847000          1.00000000
  1  1  1  1  1
          0.11566000          1.00000000
  1  1  1  1  1
          0.05104800          1.00000000
  1  1  1  1  1
          0.02120000          1.00000000
  1  2  2  1  1
         17.81000000          1.00000000
  1  2  2  1  1
          5.09000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.63000000          1.00000000
  1  2  2  1  1
          0.27000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  3  3  1  1
          2.17000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  3  3  1  1
          0.21000000          1.00000000
  1  4  4  1  1
          1.14000000          1.00000000
  1  4  4  1  1
          0.38000000          1.00000000
  1  5  5  1  1
          0.69000000          1.00000000
# SILICON
Si pc-4
 22
  1  0  0 17  3
    4615800.00000000          0.00000166          0.00000000          0.00000000
     719010.00000000          0.00001213          0.00000000          0.00000000
     169990.00000000          0.00006097          0.00000000          0.00000000
      49400.00000000          0.00025124          0.00000000          0.00000000
      16385.00000000          0.00090088         -0.00000095          0.00000000
       5985.40000000          0.00290390         -0.00000194         -0.00000381
       2354.10000000          0.00858520         -0.00004218         -0.00002900
        981.40000000          0.02342100         -0.00020469         -0.00018868
        428.90000000          0.05842200         -0.00142610         -0.00109670
        194.54000000          0.12977000         -0.00637950         -0.00533750
         90.77700000          0.24037000         -0.02866400         -0.02274900
         43.71500000          0.32480000         -0.07569500         -0.06293600
         21.49100000          0.26684000         -0.15473000         -0.12525000
         10.66900000          0.09132400          0.01591300          0.00521670
          4.88820000          0.00534240          0.46344000          0.43080000
          2.33610000          0.00000000          0.60218000          0.71833000
          1.09670000          0.00000000          0.00000000          0.38360000
  1  0  0  1  1
          0.42312000          1.00000000
  1  0  0  1  1
          0.24276000          1.00000000
  1  0  0  1  1
          0.11703000          1.00000000
  1  0  0  1  1
          0.05286100          1.00000000
  1  1  1 12  2
       6453.30000000          0.00002165          0.00000000
       1533.90000000          0.00019162          0.00000096
        498.38000000          0.00111430         -0.00000017
        188.98000000          0.00508300          0.00001992
         77.88700000          0.01926900         -0.00003897
         35.51400000          0.05309100          0.00006333
         17.01600000          0.12639000         -0.00140570
          8.49770000          0.22312000         -0.00120800
          4.35440000          0.29854000         -0.01139000
          2.25750000          0.28651000          0.00460790
          1.15970000          0.17168000         -0.00057688
          0.59343000          0.00000000          0.13174000
  1  1  1  1  1
          0.29012000          1.00000000
  1  1  1  1  1
          0.13825000          1.00000000
  1  1  1  1  1
          0.06459400          1.00000000
  1  1  1  1  1
          0.02835400          1.00000000
  1  2  2  1  1
         19.52000000          1.00000000
  1  2  2  1  1
          5.58000000          1.00000000
  1  2  2  1  1
          1.92000000          1.00000000
  1  2  2  1  1
          0.69000000          1.00000000
  1  2  2  1  1
          0.29900000          1.00000000
  1  2  2  1  1
          0.12500000          1.00000000
  1  3  3  1  1
          2.64000000          1.00000000
  1  3  3  1  1
          0.62000000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
  1  4  4  1  1
          1.35000000          1.00000000
  1  4  4  1  1
          0.45000000          1.00000000
  1  5  5  1  1
          0.78000000          1.00000000
# PHOSPHOROUS
P  pc-4
 22
  1  0  0 17  3
    5262500.00000000          0.00000167          0.00000000          0.00000000
     822130.00000000          0.00001221          0.00000000          0.00000000
     194250.00000000          0.00006144          0.00000000          0.00000000
      56424.00000000          0.00025322          0.00000000          0.00000000
      18716.00000000          0.00090752         -0.00000088          0.00000000
       6839.30000000          0.00292300         -0.00000120         -0.00000486
       2693.10000000          0.00861380         -0.00003678         -0.00003786
       1126.50000000          0.02332900         -0.00016467         -0.00024017
        495.21000000          0.05764100         -0.00118610         -0.00138650
        226.38000000          0.12694000         -0.00509360         -0.00661190
        106.62000000          0.23408000         -0.02293900         -0.02784700
         51.90500000          0.31805000         -0.05950300         -0.07656600
         25.85100000          0.27002000         -0.12532000         -0.15527000
         13.02200000          0.10197000         -0.00340880         -0.01712400
          6.05680000          0.00808990          0.33461000          0.48842000
          2.95740000          0.00000000          0.50380000          0.90895000
          1.40780000          0.00000000          0.00000000          0.53649000
  1  0  0  1  1
          0.57187000          1.00000000
  1  0  0  1  1
          0.31078000          1.00000000
  1  0  0  1  1
          0.14947000          1.00000000
  1  0  0  1  1
          0.06831300          1.00000000
  1  1  1 12  2
       7748.60000000          0.00002087          0.00000000
       1833.60000000          0.00018596          0.00000082
        595.55000000          0.00107990         -0.00000028
        226.61000000          0.00489460          0.00001597
         94.19100000          0.01832000         -0.00004740
         43.33200000          0.05066900          0.00000117
         20.90700000          0.12156000         -0.00158320
         10.50200000          0.21931000         -0.00181170
          5.42550000          0.29640000         -0.01346500
          2.88180000          0.28179000          0.00615030
          1.52840000          0.17853000         -0.00714440
          0.81081000          0.00000000          0.14315000
  1  1  1  1  1
          0.39028000          1.00000000
  1  1  1  1  1
          0.18645000          1.00000000
  1  1  1  1  1
          0.08756700          1.00000000
  1  1  1  1  1
          0.03867300          1.00000000
  1  2  2  1  1
         21.23000000          1.00000000
  1  2  2  1  1
          6.07000000          1.00000000
  1  2  2  1  1
          2.09000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  2  2  1  1
          0.13500000          1.00000000
  1  3  3  1  1
          3.12000000          1.00000000
  1  3  3  1  1
          0.73000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  4  4  1  1
          0.52000000          1.00000000
  1  5  5  1  1
          0.87000000          1.00000000
# SULFUR
S  pc-4
 22
  1  0  0 17  3
    6359200.00000000          0.00000156          0.00000000          0.00000000
     983890.00000000          0.00001156          0.00000000          0.00000000
     229770.00000000          0.00005902          0.00000000          0.00000000
      66276.00000000          0.00024474          0.00000000          0.00000000
      21884.00000000          0.00088159         -0.00000082          0.00000000
       7969.60000000          0.00284940         -0.00000103         -0.00000282
       3129.90000000          0.00842730         -0.00003412         -0.00002108
       1305.20000000          0.02295100         -0.00015187         -0.00013709
        571.70000000          0.05703800         -0.00110930         -0.00078935
        260.58000000          0.12616000         -0.00479670         -0.00382300
        122.48000000          0.23373000         -0.02168200         -0.01607200
         59.51800000          0.31883000         -0.05690800         -0.04492200
         29.62700000          0.27098000         -0.11915000         -0.09013700
         14.94300000          0.10217000         -0.00271680         -0.01063100
          7.04790000          0.00813260          0.30365000          0.27687000
          3.50400000          0.00000000          0.47588000          0.51960000
          1.69970000          0.00000000          0.00000000          0.30991000
  1  0  0  1  1
          0.73101000          1.00000000
  1  0  0  1  1
          0.37948000          1.00000000
  1  0  0  1  1
          0.18185000          1.00000000
  1  0  0  1  1
          0.08396100          1.00000000
  1  1  1 12  2
       9341.40000000          0.00001949          0.00000000
       2208.60000000          0.00017432          0.00000061
        716.27000000          0.00101610         -0.00000034
        272.51000000          0.00461720          0.00001063
        113.77000000          0.01716300         -0.00005018
         52.57100000          0.04813200         -0.00007805
         25.39700000          0.11704000         -0.00161880
         12.77000000          0.21602000         -0.00265510
          6.62240000          0.29528000         -0.01377700
          3.53880000          0.28825000          0.00242460
          1.87560000          0.17982000          0.00058572
          0.99018000          0.00000000          0.16518000
  1  1  1  1  1
          0.47723000          1.00000000
  1  1  1  1  1
          0.22692000          1.00000000
  1  1  1  1  1
          0.10473000          1.00000000
  1  1  1  1  1
          0.04530300          1.00000000
  1  2  2  1  1
         22.93000000          1.00000000
  1  2  2  1  1
          6.55000000          1.00000000
  1  2  2  1  1
          2.26000000          1.00000000
  1  2  2  1  1
          0.81000000          1.00000000
  1  2  2  1  1
          0.35100000          1.00000000
  1  2  2  1  1
          0.14600000          1.00000000
  1  3  3  1  1
          3.59000000          1.00000000
  1  3  3  1  1
          0.84000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          1.76000000          1.00000000
  1  4  4  1  1
          0.59000000          1.00000000
  1  5  5  1  1
          0.95000000          1.00000000
# CHLORINE
Cl pc-4
 22
  1  0  0 17  3
    7421200.00000000          0.00000150          0.00000000          0.00000000
    1141100.00000000          0.00001124          0.00000000          0.00000000
     264430.00000000          0.00005800          0.00000000          0.00000000
      75791.00000000          0.00024215          0.00000000          0.00000000
      24925.00000000          0.00087550         -0.00000134          0.00000000
       9052.60000000          0.00283760         -0.00000184         -0.00000371
       3548.10000000          0.00840860         -0.00005817         -0.00002924
       1478.00000000          0.02290600         -0.00026634         -0.00018902
        647.35000000          0.05689500         -0.00191720         -0.00109400
        295.33000000          0.12569000         -0.00835970         -0.00529080
        138.98000000          0.23327000         -0.03750200         -0.02220500
         67.54900000          0.31894000         -0.09949500         -0.06245500
         33.66100000          0.27117000         -0.20640000         -0.12439000
         17.02700000          0.10247000         -0.00520630         -0.01497300
          8.15040000          0.00830670          0.50048000          0.36440000
          4.13190000          0.00000000          0.83332000          0.68717000
          2.04570000          0.00000000          0.00000000          0.39343000
  1  0  0  1  1
          0.94029000          1.00000000
  1  0  0  1  1
          0.46901000          1.00000000
  1  0  0  1  1
          0.22219000          1.00000000
  1  0  0  1  1
          0.10220000          1.00000000
  1  1  1 12  2
      11035.00000000          0.00001851          0.00000000
       2611.50000000          0.00016527          0.00000056
        848.02000000          0.00096233         -0.00000035
        323.00000000          0.00437770          0.00000920
        135.33000000          0.01621800         -0.00005112
         62.68400000          0.04610400         -0.00010597
         30.29800000          0.11348000         -0.00166890
         15.24000000          0.21353000         -0.00309980
          7.92590000          0.29438000         -0.01462800
          4.28530000          0.28778000          0.00123450
          2.30430000          0.18269000          0.00153150
          1.23570000          0.00000000          0.16993000
  1  1  1  1  1
          0.60021000          1.00000000
  1  1  1  1  1
          0.28739000          1.00000000
  1  1  1  1  1
          0.13185000          1.00000000
  1  1  1  1  1
          0.05697000          1.00000000
  1  2  2  1  1
         24.63000000          1.00000000
  1  2  2  1  1
          7.04000000          1.00000000
  1  2  2  1  1
          2.43000000          1.00000000
  1  2  2  1  1
          0.87000000          1.00000000
  1  2  2  1  1
          0.37700000          1.00000000
  1  2  2  1  1
          0.15700000          1.00000000
  1  3  3  1  1
          4.06000000          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
  1  3  3  1  1
          0.39000000          1.00000000
  1  4  4  1  1
          1.97000000          1.00000000
  1  4  4  1  1
          0.66000000          1.00000000
  1  5  5  1  1
          1.04000000          1.00000000
# ARGON
Ar pc-4
 22
  1  0  0 17  3
    9445100.00000000          0.00000065          0.00000000          0.00000000
    1414100.00000000          0.00000503          0.00000000          0.00000000
     321810.00000000          0.00002648          0.00000000          0.00000000
      91158.00000000          0.00011190          0.00000000          0.00000000
      29743.00000000          0.00040791         -0.00000056          0.00000000
      10740.00000000          0.00133090         -0.00000040         -0.00000430
       4190.00000000          0.00396580         -0.00002366         -0.00003226
       1738.90000000          0.01086300         -0.00010267         -0.00021559
        759.29000000          0.02715900         -0.00077891         -0.00124380
        345.50000000          0.06051400         -0.00337400         -0.00612440
        162.36000000          0.11351000         -0.01548200         -0.02587800
         78.88800000          0.15827000         -0.04168700         -0.07483000
         39.32100000          0.13900000         -0.08942400         -0.15278000
         19.91800000          0.05564500         -0.01062200         -0.03707900
          9.57640000          0.00513770          0.20099000          0.43524000
          4.91610000          0.00000000          0.36722000          0.88582000
          2.46480000          0.00000000          0.00000000          0.60951000
  1  0  0  1  1
          1.18300000          1.00000000
  1  0  0  1  1
          0.57521000          1.00000000
  1  0  0  1  1
          0.27041000          1.00000000
  1  0  0  1  1
          0.12312000          1.00000000
  1  1  1 12  2
      13006.00000000          0.00000869          0.00000000
       3078.10000000          0.00007761          0.00000276
        999.56000000          0.00045249         -0.00000183
        380.97000000          0.00205950          0.00004540
        160.28000000          0.00758720         -0.00025551
         74.49400000          0.02182200         -0.00054968
         36.06500000          0.05433200         -0.00835420
         18.16400000          0.10442000         -0.01650400
          9.46650000          0.14645000         -0.07654200
          5.16300000          0.14426000          0.00166060
          2.80850000          0.09437900          0.00120150
          1.52350000          0.00000000          0.85169000
  1  1  1  1  1
          0.74379000          1.00000000
  1  1  1  1  1
          0.35680000          1.00000000
  1  1  1  1  1
          0.16221000          1.00000000
  1  1  1  1  1
          0.06995600          1.00000000
  1  2  2  1  1
         26.33000000          1.00000000
  1  2  2  1  1
          7.53000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          0.93000000          1.00000000
  1  2  2  1  1
          0.41000000          1.00000000
  1  2  2  1  1
          0.17000000          1.00000000
  1  3  3  1  1
          4.53000000          1.00000000
  1  3  3  1  1
          1.06000000          1.00000000
  1  3  3  1  1
          0.44000000          1.00000000
  1  4  4  1  1
          2.18000000          1.00000000
  1  4  4  1  1
          0.73000000          1.00000000
  1  5  5  1  1
          1.12000000          1.00000000
#  aug-pc-0  EMSL  Basis Set Exchange Library  6/6/08 12:16 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-0
  3
  1  0  0  2  1
          4.34480000          0.07929900
          0.66049000          0.42422000
  1  0  0  1  1
          0.13669000          1.00000000
  1  0  0  1  1
          0.02717400          1.00000000
# HELIUM
He aug-pc-0
  3
  1  0  0  2  1
         13.21000000          0.04350600
          1.94340000          0.21166000
  1  0  0  1  1
          0.35443000          1.00000000
  1  0  0  1  1
          0.06237000          1.00000000
# LITHIUM
Li aug-pc-0
  5
  1  0  0  4  2
         97.58500000          0.02235800          0.00000000
         14.75500000          0.14499000          0.00518750
          3.22330000          0.34594000          0.16698000
          0.78789000          0.00000000          0.72566000
  1  0  0  1  1
          0.05100900          1.00000000
  1  0  0  1  1
          0.01229000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  1  1  1  1
          0.03687000          1.00000000
# BERYLLIUM
Be aug-pc-0
  5
  1  0  0  4  2
        187.54000000          0.01037300          0.00000000
         28.34500000          0.07200700         -0.00205070
          6.26140000          0.13085000          0.11312000
          1.58370000          0.00000000          0.30800000
  1  0  0  1  1
          0.10858000          1.00000000
  1  0  0  1  1
          0.02585000          1.00000000
  1  1  1  1  1
          0.43000000          1.00000000
  1  1  1  1  1
          0.07755000          1.00000000
# BORON
B  aug-pc-0
  6
  1  0  0  4  2
        303.73000000          0.02012100          0.00000000
         45.89400000          0.14410000         -0.00738180
         10.20500000          0.21961000          0.26153000
          2.63480000          0.00000000          0.59363000
  1  0  0  1  1
          0.19380000          1.00000000
  1  0  0  1  1
          0.04560000          1.00000000
  1  1  1  2  1
          2.79040000          0.10986000
          0.54195000          0.46846000
  1  1  1  1  1
          0.11876000          1.00000000
  1  1  1  1  1
          0.02494000          1.00000000
# CARBON
C  aug-pc-0
  6
  1  0  0  4  2
        446.51000000          0.01978800          0.00000000
         67.46200000          0.14534000         -0.00999100
         15.06700000          0.18529000          0.28519000
          3.93880000          0.00000000          0.56687000
  1  0  0  1  1
          0.29991000          1.00000000
  1  0  0  1  1
          0.06974800          1.00000000
  1  1  1  2  1
          4.36770000          0.11671000
          0.86982000          0.47558000
  1  1  1  1  1
          0.18893000          1.00000000
  1  1  1  1  1
          0.03936100          1.00000000
# NITROGEN
N  aug-pc-0
  6
  1  0  0  4  2
        615.85000000          0.01958800          0.00000000
         93.04400000          0.14695000         -0.01205900
         20.84800000          0.15560000          0.30199000
          5.49590000          0.00000000          0.54090000
  1  0  0  1  1
          0.42624000          1.00000000
  1  0  0  1  1
          0.09798600          1.00000000
  1  1  1  2  1
          6.26800000          0.12134000
          1.26900000          0.48013000
  1  1  1  1  1
          0.27390000          1.00000000
  1  1  1  1  1
          0.05670900          1.00000000
# OXYGEN
O  aug-pc-0
  6
  1  0  0  4  2
        812.12000000          0.01945000          0.00000000
        122.69000000          0.14774000         -0.01318900
         27.56100000          0.13593000          0.31510000
          7.31730000          0.00000000          0.52964000
  1  0  0  1  1
          0.57924000          1.00000000
  1  0  0  1  1
          0.13165000          1.00000000
  1  1  1  2  1
          8.21780000          0.12902000
          1.67540000          0.48706000
  1  1  1  1  1
          0.35067000          1.00000000
  1  1  1  1  1
          0.07041600          1.00000000
# FLUORINE
F  aug-pc-0
  6
  1  0  0  4  2
       1035.10000000          0.01935100          0.00000000
        156.38000000          0.14884000         -0.01433700
         35.19600000          0.11735000          0.32551000
          9.39210000          0.00000000          0.51681000
  1  0  0  1  1
          0.75342000          1.00000000
  1  0  0  1  1
          0.16931000          1.00000000
  1  1  1  2  1
         10.59900000          0.13273000
          2.17330000          0.48938000
  1  1  1  1  1
          0.44871000          1.00000000
  1  1  1  1  1
          0.08902900          1.00000000
# NEON
Ne aug-pc-0
  6
  1  0  0  4  2
       1284.50000000          0.09641900          0.00000000
        194.05000000          0.75019000         -0.00767080
         43.74600000          0.49765000          0.16693000
         11.72000000          0.00000000          0.25151000
  1  0  0  1  1
          0.94746000          1.00000000
  1  0  0  1  1
          0.21050000          1.00000000
  1  1  1  2  1
         13.34800000          0.06746700
          2.75090000          0.24531000
  1  1  1  1  1
          0.56434000          1.00000000
  1  1  1  1  1
          0.11120000          1.00000000
# SODIUM
Na aug-pc-0
  6
  1  0  0  7  3
       4553.50000000          0.00515830          0.00000000          0.00000000
        685.09000000          0.03860000         -0.00031854          0.00000000
        155.73000000          0.17385000         -0.00226480         -0.00007913
         43.37100000          0.45646000         -0.03392300         -0.00069906
         13.33900000          0.46291000         -0.07630900         -0.00320830
          2.31060000          0.00000000          0.33727000          0.03005600
          0.70669000          0.00000000          0.00000000          0.11224000
  1  0  0  1  1
          0.04594200          1.00000000
  1  0  0  1  1
          0.01141000          1.00000000
  1  1  1  4  1
         37.79300000          0.04649500
          8.41340000          0.24311000
          2.32100000          0.51738000
          0.60658000          0.42598000
  1  1  1  1  1
          0.09500000          1.00000000
  1  1  1  1  1
          0.03167000          1.00000000
# MAGNESIUM
Mg aug-pc-0
  6
  1  0  0  7  3
       5520.80000000          0.00252540          0.00000000          0.00000000
        830.56000000          0.01893200         -0.00015190          0.00000000
        188.81000000          0.08556500         -0.00087484         -0.00116040
         52.63800000          0.22776000         -0.01460700         -0.00988450
         16.23300000          0.23565000         -0.03034900         -0.04341600
          2.92750000          0.00000000          0.10360000          0.31196000
          0.94786000          0.00000000          0.00000000          0.72645000
  1  0  0  1  1
          0.07636100          1.00000000
  1  0  0  1  1
          0.01989000          1.00000000
  1  1  1  4  1
         49.45300000          0.02173900
         11.11600000          0.11690000
          3.12730000          0.25993000
          0.85940000          0.21108000
  1  1  1  1  1
          0.16000000          1.00000000
  1  1  1  1  1
          0.05333000          1.00000000
# ALUMINUM
Al aug-pc-0
  6
  1  0  0  7  3
       6587.10000000          0.00495700          0.00000000          0.00000000
        990.92000000          0.03722300         -0.00029525          0.00000000
        225.29000000          0.16875000         -0.00156740         -0.00034383
         62.86600000          0.45505000         -0.02743400         -0.00293810
         19.43200000          0.48010000         -0.05560000         -0.01304700
          3.62070000          0.00000000          0.15188000          0.08567900
          1.22880000          0.00000000          0.00000000          0.18025000
  1  0  0  1  1
          0.12068000          1.00000000
  1  0  0  1  1
          0.02898000          1.00000000
  1  1  1  5  2
         72.36500000          0.03295300          0.00000000
         16.54300000          0.18989000         -0.00030607
          4.82390000          0.47489000         -0.00812540
          1.43360000          0.48033000          0.00582160
          0.27689000          0.00000000          0.37831000
  1  1  1  1  1
          0.06985600          1.00000000
  1  1  1  1  1
          0.01678000          1.00000000
# SILICON
Si aug-pc-0
  6
  1  0  0  7  3
       7743.00000000          0.00488250          0.00000000          0.00000000
       1164.70000000          0.03674100         -0.00029111          0.00000000
        264.82000000          0.16695000         -0.00141220         -0.00044437
         73.96800000          0.45657000         -0.02604600         -0.00380670
         22.91200000          0.49043000         -0.05093300         -0.01707800
          4.37410000          0.00000000          0.10810000          0.10569000
          1.53910000          0.00000000          0.00000000          0.20429000
  1  0  0  1  1
          0.16775000          1.00000000
  1  0  0  1  1
          0.04273000          1.00000000
  1  1  1  5  2
         96.08000000          0.02803500          0.00000000
         22.15000000          0.16819000         -0.00072797
          6.56300000          0.45197000         -0.00866440
          2.02500000          0.50132000         -0.00353440
          0.47780000          0.00000000          0.31085000
  1  1  1  1  1
          0.12824000          1.00000000
  1  1  1  1  1
          0.03266600          1.00000000
# PHOSPHOROUS
P  aug-pc-0
  6
  1  0  0  7  3
       8990.80000000          0.00482060          0.00000000          0.00000000
       1352.40000000          0.03639200          0.00289000          0.00000000
        307.50000000          0.16563000          0.01263800         -0.00054512
         85.94100000          0.46217000          0.24790000         -0.00468380
         26.67100000          0.50582000          0.46165000         -0.02116000
          5.18810000          0.00000000         -0.70180000          0.12534000
          1.87780000          0.00000000          0.00000000          0.22427000
  1  0  0  1  1
          0.22010000          1.00000000
  1  0  0  1  1
          0.05606900          1.00000000
  1  1  1  5  2
        111.64000000          0.02866300          0.00000000
         25.78400000          0.17265000         -0.00068545
          7.67250000          0.46181000         -0.01129600
          2.39960000          0.49174000          0.00329620
          0.54943000          0.00000000          0.41613000
  1  1  1  1  1
          0.14748000          1.00000000
  1  1  1  1  1
          0.03756900          1.00000000
# SULFUR
S  aug-pc-0
  6
  1  0  0  7  3
      10330.00000000          0.00476850          0.00000000          0.00000000
       1553.70000000          0.03620900          0.00289030          0.00000000
        353.30000000          0.16491000          0.01157500         -0.00062501
         98.80500000          0.47548000          0.23993000         -0.00538810
         30.71600000          0.53319000          0.42830000         -0.02452100
          6.06330000          0.00000000         -0.42063000          0.14132000
          2.24750000          0.00000000          0.00000000          0.23948000
  1  0  0  1  1
          0.27853000          1.00000000
  1  0  0  1  1
          0.07074900          1.00000000
  1  1  1  5  2
        129.76000000          0.02870600          0.00000000
         30.02500000          0.17420000         -0.00011785
          8.97330000          0.46709000         -0.01448300
          2.84400000          0.48571000          0.01593900
          0.63361000          0.00000000          0.48257000
  1  1  1  1  1
          0.16955000          1.00000000
  1  1  1  1  1
          0.04306700          1.00000000
# CHLORINE
Cl aug-pc-0
  6
  1  0  0  7  3
      11759.00000000          0.00472480          0.00000000          0.00000000
       1768.60000000          0.03654600          0.00290530          0.00000000
        402.19000000          0.16597000          0.01066400         -0.00069197
        112.54000000          0.52530000          0.23406000         -0.00597600
         35.03900000          0.61955000          0.39915000         -0.02739400
          6.99560000          0.00000000         -0.17937000          0.15516000
          2.64550000          0.00000000          0.00000000          0.25028000
  1  0  0  1  1
          0.34157000          1.00000000
  1  0  0  1  1
          0.08657700          1.00000000
  1  1  1  5  2
        150.66000000          0.02829900          0.00000000
         34.93300000          0.17336000          0.00013598
         10.49200000          0.46812000         -0.01661100
          3.37260000          0.48321000          0.02235100
          0.75989000          0.00000000          0.51192000
  1  1  1  1  1
          0.20289000          1.00000000
  1  1  1  1  1
          0.05142700          1.00000000
# ARGON
Ar aug-pc-0
  6
  1  0  0  7  3
      13277.00000000          0.02344000          0.00000000          0.00000000
       1996.90000000          0.15225000          0.00146890          0.00000000
        454.12000000          0.72536000          0.00492820         -0.00037469
        127.14000000          0.33180000          0.11458000         -0.00324620
         39.63700000         -0.63751000          0.18548000         -0.01496800
          7.98170000          0.00000000          0.02189400          0.08393600
          3.07060000          0.00000000          0.00000000          0.12891000
  1  0  0  1  1
          0.40908000          1.00000000
  1  0  0  1  1
          0.10390000          1.00000000
  1  1  1  5  2
        173.23000000          0.01395500          0.00000000
         40.23900000          0.08622600          0.00013131
         12.13900000          0.23423000         -0.00914820
          3.95270000          0.24062000          0.01328000
          0.90626000          0.00000000          0.26503000
  1  1  1  1  1
          0.24252000          1.00000000
  1  1  1  1  1
          0.06160000          1.00000000
#  aug-pc-1  EMSL  Basis Set Exchange Library  6/6/08 12:17 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-1
  5
  1  0  0  3  1
         12.25200000          0.02282200
          1.86870000          0.15564000
          0.41821000          0.48898000
  1  0  0  1  1
          0.10610000          1.00000000
  1  0  0  1  1
          0.02562800          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
  1  1  1  1  1
          0.07688400          1.00000000
# HELIUM
He aug-pc-1
  5
  1  0  0  3  1
         36.86500000          0.01306200
          5.58020000          0.08349100
          1.19170000          0.23874000
  1  0  0  1  1
          0.26892000          1.00000000
  1  0  0  1  1
          0.05807000          1.00000000
  1  1  1  1  1
          1.45000000          1.00000000
  1  1  1  1  1
          0.17420000          1.00000000
# LITHIUM
Li aug-pc-1
  6
  1  0  0  6  2
        266.43000000          0.00652680          0.00000000
         40.16000000          0.04806500          0.00001102
          9.10820000          0.20095000         -0.00268490
          2.45430000          0.47007000         -0.01871100
          0.69626000          0.43130000         -0.08894800
          0.08372600          0.00000000          0.51836000
  1  0  0  1  1
          0.03082700          1.00000000
  1  0  0  1  1
          0.01057000          1.00000000
  1  1  1  2  1
          1.62000000          0.04165510
          0.32000000          0.11044500
  1  1  1  1  1
          0.09000000          1.00000000
  1  1  1  1  1
          0.03171000          1.00000000
# BERYLLIUM
Be aug-pc-1
  6
  1  0  0  6  2
        514.90000000          0.00300310          0.00000000
         77.55800000          0.02224300         -0.00009600
         17.60900000          0.09543400         -0.00121790
          4.80800000          0.23228000         -0.01369900
          1.40850000          0.22104000         -0.04215900
          0.19069000          0.00000000          0.26185000
  1  0  0  1  1
          0.06112500          1.00000000
  1  0  0  1  1
          0.01841000          1.00000000
  1  1  1  2  1
          3.42000000          0.04935190
          0.68000000          0.18982100
  1  1  1  1  1
          0.19000000          1.00000000
  1  1  1  1  1
          0.05523000          1.00000000
# BORON
B  aug-pc-1
  8
  1  0  0  6  2
        843.98000000          0.00573610          0.00000000
        127.08000000          0.04262500         -0.00023303
         28.86200000          0.18576000         -0.00254790
          7.92970000          0.46258000         -0.03092800
          2.36370000          0.44646000         -0.08695600
          0.34670000          0.00000000          0.53062000
  1  0  0  1  1
          0.10595000          1.00000000
  1  0  0  1  1
          0.03052000          1.00000000
  1  1  1  3  1
          5.81280000          0.04308400
          1.20020000          0.22295000
          0.32686000          0.50977000
  1  1  1  1  1
          0.08626400          1.00000000
  1  1  1  1  1
          0.02163000          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.06488000          1.00000000
# CARBON
C  aug-pc-1
  8
  1  0  0  6  2
       1252.60000000          0.00557360          0.00000000
        188.57000000          0.04149600         -0.00027440
         42.83900000          0.18263000         -0.00255830
         11.81800000          0.46129000         -0.03337500
          3.55670000          0.44931000         -0.08730500
          0.54258000          0.00000000          0.53415000
  1  0  0  1  1
          0.16058000          1.00000000
  1  0  0  1  1
          0.04485600          1.00000000
  1  1  1  3  1
          9.14260000          0.04449900
          1.92980000          0.23108000
          0.52522000          0.51227000
  1  1  1  1  1
          0.13608000          1.00000000
  1  1  1  1  1
          0.03351800          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.10055000          1.00000000
# NITROGEN
N  aug-pc-1
  8
  1  0  0  6  2
       1742.20000000          0.00546030          0.00000000
        262.21000000          0.04070600         -0.00030104
         59.58500000          0.18038000         -0.00255110
         16.48900000          0.46009000         -0.03490000
          4.99450000          0.45173000         -0.08742900
          0.78673000          0.00000000          0.52660000
  1  0  0  1  1
          0.22837000          1.00000000
  1  0  0  1  1
          0.06273900          1.00000000
  1  1  1  3  1
         13.13200000          0.04551500
          2.81080000          0.23740000
          0.76351000          0.51392000
  1  1  1  1  1
          0.19560000          1.00000000
  1  1  1  1  1
          0.04770700          1.00000000
  1  2  2  1  1
          0.90000000          1.00000000
  1  2  2  1  1
          0.14312000          1.00000000
# OXYGEN
O  aug-pc-1
  8
  1  0  0  6  2
       2306.70000000          0.00539400          0.00000000
        347.15000000          0.04024800         -0.00031692
         78.89000000          0.17921000         -0.00259440
         21.87600000          0.45978000         -0.03624100
          6.66460000          0.45234000         -0.08779000
          1.06690000          0.00000000          0.53320000
  1  0  0  1  1
          0.30700000          1.00000000
  1  0  0  1  1
          0.08342500          1.00000000
  1  1  1  3  1
         17.02200000          0.04891900
          3.68380000          0.24962000
          0.99234000          0.51347000
  1  1  1  1  1
          0.24487000          1.00000000
  1  1  1  1  1
          0.05761600          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  2  2  1  1
          0.17285000          1.00000000
# FLUORINE
F  aug-pc-1
  8
  1  0  0  6  2
       2954.60000000          0.00533370          0.00000000
        444.62000000          0.03982700         -0.00032962
        101.05000000          0.17802000         -0.00260830
         28.06800000          0.45917000         -0.03715000
          8.58370000          0.45352000         -0.08817800
          1.39860000          0.00000000          0.53135000
  1  0  0  1  1
          0.39969000          1.00000000
  1  0  0  1  1
          0.10802000          1.00000000
  1  1  1  3  1
         21.88300000          0.05024400
          4.77690000          0.25424000
          1.28230000          0.51220000
  1  1  1  1  1
          0.31127000          1.00000000
  1  1  1  1  1
          0.07205400          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.21616000          1.00000000
# NEON
Ne aug-pc-1
  8
  1  0  0  6  2
       3680.10000000          0.00264540          0.00000000
        553.75000000          0.01976300         -0.00017209
        125.87000000          0.08859000         -0.00130160
         35.01300000          0.22936000         -0.01898000
         10.73900000          0.22717000         -0.04400800
          1.76930000          0.00000000          0.26525000
  1  0  0  1  1
          0.50149000          1.00000000
  1  0  0  1  1
          0.13450000          1.00000000
  1  1  1  3  1
         27.50200000          0.02547700
          6.03970000          0.12855000
          1.61900000          0.25586000
  1  1  1  1  1
          0.38970000          1.00000000
  1  1  1  1  1
          0.08950000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.26850000          1.00000000
# SODIUM
Na aug-pc-1
  6
  1  0  0 10  3
      23207.00000000          0.00068100          0.00000000          0.00000000
       3481.60000000          0.00525120         -0.00002932          0.00000000
        792.72000000          0.02684500         -0.00003220         -0.00000132
        224.59000000          0.10188000         -0.00214850         -0.00001438
         73.08800000          0.27784000         -0.00931570         -0.00013687
         26.19000000          0.44489000         -0.06707100         -0.00048799
          9.86610000          0.28206000         -0.05678900         -0.00028773
          2.21550000          0.02068500          0.53608000         -0.01017800
          0.68590000          0.00000000          0.59788000         -0.11118000
          0.07033700          0.00000000          0.00000000          0.59314000
  1  0  0  1  1
          0.02607500          1.00000000
  1  0  0  1  1
          0.00900100          1.00000000
  1  1  1  6  1
        135.55000000          0.00617590
         31.56200000          0.04531500
          9.67740000          0.17332000
          3.36910000          0.36867000
          1.17030000          0.43998000
          0.37651000          0.22613000
  1  1  1  1  1
          0.07500000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
# MAGNESIUM
Mg aug-pc-1
  6
  1  0  0 10  3
      28706.00000000          0.00032513          0.00000000          0.00000000
       4306.60000000          0.00250760         -0.00001306          0.00000000
        980.54000000          0.01283700         -0.00001798          0.00000116
        277.76000000          0.04896400         -0.00100360          0.00001351
         90.38600000          0.13517000         -0.00468190          0.00013542
         32.37400000          0.22193000         -0.03305100          0.00075360
         12.17700000          0.14657000         -0.03271800          0.00150980
          2.81660000          0.01198000          0.26039000         -0.01906800
          0.92173000          0.00000000          0.30808000         -0.07524100
          0.12709000          0.00000000          0.00000000          0.27161000
  1  0  0  1  1
          0.04608000          1.00000000
  1  0  0  1  1
          0.01558000          1.00000000
  1  1  1  6  1
        177.60000000          0.00282590
         41.44200000          0.02110300
         12.81800000          0.08266600
          4.51740000          0.18285000
          1.61280000          0.22357000
          0.54531000          0.10869000
  1  1  1  1  1
          0.13500000          1.00000000
  1  1  1  1  1
          0.04500000          1.00000000
# ALUMINUM
Al aug-pc-1
  8
  1  0  0 10  3
      34702.00000000          0.00062778          0.00000000          0.00000000
       5205.90000000          0.00484320         -0.00002388          0.00000000
       1185.20000000          0.02481700         -0.00003937          0.00000451
        335.70000000          0.09502800         -0.00191680          0.00005323
        109.23000000          0.26474000         -0.00943620          0.00053333
         39.12000000          0.44274000         -0.06573900          0.00287540
         14.70900000          0.30134000         -0.07223200          0.00567340
          3.48960000          0.02681700          0.50924000         -0.05813300
          1.19360000          0.00000000          0.62972000         -0.18753000
          0.19585000          0.00000000          0.00000000          0.58570000
  1  0  0  1  1
          0.07143900          1.00000000
  1  0  0  1  1
          0.02429000          1.00000000
  1  1  1  7  2
        254.36000000          0.00429030          0.00000000
         59.51400000          0.03305500          0.00010756
         18.70800000          0.13486000         -0.00081981
          6.73620000          0.32836000         -0.00142160
          2.50450000          0.44798000         -0.01493000
          0.90820000          0.27040000          0.04377900
          0.20909000          0.00000000          0.49039000
  1  1  1  1  1
          0.05699000          1.00000000
  1  1  1  1  1
          0.01473000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.04419000          1.00000000
# SILICON
Si aug-pc-1
  8
  1  0  0 10  3
      41263.00000000          0.00060948          0.00000000          0.00000000
       6189.60000000          0.00470400         -0.00002246          0.00000000
       1408.70000000          0.02413600         -0.00004176          0.00000603
        398.77000000          0.09276200         -0.00185700          0.00007428
        129.69000000          0.26047000         -0.00951130          0.00074023
         46.42500000          0.44181000         -0.06580000          0.00401070
         17.45500000          0.30755000         -0.07754600          0.00801370
          4.22220000          0.02919700          0.50303000         -0.07409100
          1.49330000          0.00000000          0.63824000         -0.21382000
          0.27174000          0.00000000          0.00000000          0.61263000
  1  0  0  1  1
          0.09850200          1.00000000
  1  0  0  1  1
          0.03329300          1.00000000
  1  1  1  7  2
        310.73000000          0.00411980          0.00000000
         72.82300000          0.03198100          0.00012637
         22.98500000          0.13224000         -0.00102520
          8.32130000          0.32779000         -0.00213370
          3.13530000          0.45107000         -0.01877400
          1.16930000          0.26345000          0.05752800
          0.29281000          0.00000000          0.53571000
  1  1  1  1  1
          0.08270400          1.00000000
  1  1  1  1  1
          0.02211100          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          0.06633200          1.00000000
# PHOSPHOROUS
P  aug-pc-1
  8
  1  0  0 10  3
      48073.00000000          0.00059919          0.00000000          0.00000000
       7211.40000000          0.00462410         -0.00002131          0.00000000
       1641.70000000          0.02372400         -0.00004422          0.00000713
        464.92000000          0.09130300         -0.00182210          0.00008450
        151.28000000          0.25750000         -0.00963660          0.00085919
         54.18900000          0.44080000         -0.06607200          0.00464780
         20.39700000          0.31175000         -0.08182400          0.00958110
          5.02410000          0.03111800          0.49850000         -0.08406600
          1.82460000          0.00000000          0.64492000         -0.23124000
          0.35871000          0.00000000          0.00000000          0.62350000
  1  0  0  1  1
          0.12887000          1.00000000
  1  0  0  1  1
          0.04319400          1.00000000
  1  1  1  7  2
        366.24000000          0.00409770          0.00000000
         85.93100000          0.03195600          0.00012506
         27.17200000          0.13326000         -0.00121660
          9.86850000          0.33228000         -0.00318130
          3.75330000          0.45335000         -0.02147500
          1.43020000          0.25058000          0.06999100
          0.38653000          0.00000000          0.56081000
  1  1  1  1  1
          0.11146000          1.00000000
  1  1  1  1  1
          0.03038600          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.09115700          1.00000000
# SULFUR
S  aug-pc-1
  8
  1  0  0 10  3
      55510.00000000          0.00058899          0.00000000          0.00000000
       8326.70000000          0.00454600         -0.00002048          0.00000000
       1895.60000000          0.02333500         -0.00004543          0.00000835
        536.77000000          0.08996500         -0.00179370          0.00009831
        174.67000000          0.25486000         -0.00972520          0.00100400
         62.57800000          0.43998000         -0.06639900          0.00544090
         23.57300000          0.31549000         -0.08550200          0.01140000
          5.89080000          0.03282600          0.49588000         -0.09513400
          2.18520000          0.00000000          0.64988000         -0.24735000
          0.45282000          0.00000000          0.00000000          0.63973000
  1  0  0  1  1
          0.16202000          1.00000000
  1  0  0  1  1
          0.05410000          1.00000000
  1  1  1  7  2
        395.45000000          0.00462660          0.00000000
         92.83400000          0.03589800          0.00010934
         29.26600000          0.14854000         -0.00163580
         10.59500000          0.35878000         -0.00506320
          4.02720000          0.45417000         -0.02396000
          1.54840000          0.20545000          0.10388000
          0.46134000          0.00000000          0.58063000
  1  1  1  1  1
          0.13131000          1.00000000
  1  1  1  1  1
          0.03536400          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.10609000          1.00000000
# CHLORINE
Cl aug-pc-1
  8
  1  0  0 10  3
      63474.00000000          0.00058028          0.00000000          0.00000000
       9521.30000000          0.00447920         -0.00001982          0.00000000
       2167.40000000          0.02300000         -0.00004720          0.00000906
        613.74000000          0.08881500         -0.00177130          0.00010695
        199.72000000          0.25258000         -0.00980680          0.00109810
         71.56400000          0.43921000         -0.06671900          0.00598980
         26.97900000          0.31868000         -0.08871100          0.01276200
          6.82600000          0.03434800          0.49396000         -0.10307000
          2.57670000          0.00000000          0.65392000         -0.25941000
          0.55752000          0.00000000          0.00000000          0.64899000
  1  0  0  1  1
          0.19825000          1.00000000
  1  0  0  1  1
          0.06581600          1.00000000
  1  1  1  7  2
        413.12000000          0.00542510          0.00000000
         97.05400000          0.04164400         -0.00000174
         30.48200000          0.16990000         -0.00214410
         10.96200000          0.39275000         -0.00912980
          4.12760000          0.45045000         -0.01990600
          1.53380000          0.15308000          0.15582000
          0.51439000          0.00000000          0.58772000
  1  1  1  1  1
          0.15026000          1.00000000
  1  1  1  1  1
          0.04146700          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          0.12440000          1.00000000
# ARGON
Ar aug-pc-1
  8
  1  0  0 10  3
      71956.00000000          0.00028643          0.00000000          0.00000000
      10793.00000000          0.00221120         -0.00000961          0.00000000
       2457.00000000          0.01135800         -0.00002414          0.00000479
        695.72000000          0.04391600         -0.00087570          0.00005758
        226.40000000          0.12531000         -0.00493760          0.00058972
         81.13800000          0.21927000         -0.03351200          0.00323990
         30.61200000          0.16071000         -0.04576400          0.00698140
          7.82910000          0.01784900          0.24633000         -0.05491800
          2.99870000          0.00000000          0.32863000         -0.13472000
          0.67242000          0.00000000          0.00000000          0.32734000
  1  0  0  1  1
          0.23719000          1.00000000
  1  0  0  1  1
          0.07815000          1.00000000
  1  1  1  7  2
        446.27000000          0.00296130          0.00000000
        104.94000000          0.02259100         -0.00006082
         32.93100000          0.09152400         -0.00126610
         11.80900000          0.20642000         -0.00645890
          4.43040000          0.22195000         -0.00651050
          1.57510000          0.06276500          0.10436000
          0.56412000          0.00000000          0.29184000
  1  1  1  1  1
          0.17015000          1.00000000
  1  1  1  1  1
          0.04839000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.14520000          1.00000000
#  aug-pc-2  EMSL  Basis Set Exchange Library  6/6/08 12:17 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-2
  9
  1  0  0  4  1
         75.42300000          0.00240650
         11.35000000          0.01848700
          2.59930000          0.08974200
          0.73513000          0.28111000
  1  0  0  1  1
          0.23167000          1.00000000
  1  0  0  1  1
          0.07414700          1.00000000
  1  0  0  1  1
          0.02233400          1.00000000
  1  1  1  1  1
          1.60000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  1  1  1  1
          0.06700100          1.00000000
  1  2  2  1  1
          1.25000000          1.00000000
  1  2  2  1  1
          0.08933400          1.00000000
# HELIUM
He aug-pc-2
  9
  1  0  0  4  1
        221.77000000          0.00144090
         33.37500000          0.01089400
          7.61140000          0.05018900
          2.10890000          0.14290000
  1  0  0  1  1
          0.62878000          1.00000000
  1  0  0  1  1
          0.18469000          1.00000000
  1  0  0  1  1
          0.05123000          1.00000000
  1  1  1  1  1
          2.40000000          1.00000000
  1  1  1  1  1
          0.68000000          1.00000000
  1  1  1  1  1
          0.15370000          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.20490000          1.00000000
# LITHIUM
Li aug-pc-2
  9
  1  0  0  8  2
       1502.50000000          0.00076137          0.00000000
        225.51000000          0.00587120          0.00002104
         51.37500000          0.02974300         -0.00012177
         14.54700000          0.10959000         -0.00010088
          4.66450000          0.28000000         -0.00844260
          1.60080000          0.44163000         -0.02439400
          0.55262000          0.29922000         -0.09071800
          0.10366000          0.00000000          0.30659000
  1  0  0  1  1
          0.04744200          1.00000000
  1  0  0  1  1
          0.01979000          1.00000000
  1  0  0  1  1
          0.00762000          1.00000000
  1  1  1  3  1
          5.30000000          0.00554503
          1.15000000          0.05509120
          0.29000000          0.08756150
  1  1  1  1  1
          0.09000000          1.00000000
  1  1  1  1  1
          0.02286000          1.00000000
  1  2  2  1  1
          0.26000000          1.00000000
  1  2  2  1  1
          0.03048000          1.00000000
# BERYLLIUM
Be aug-pc-2
  9
  1  0  0  8  2
       3067.30000000          0.00032683          0.00000000
        460.24000000          0.00252340          0.00000139
        104.80000000          0.01286700         -0.00003643
         29.65700000          0.04860700         -0.00033196
          9.53650000          0.13111000         -0.00366180
          3.31060000          0.22124000         -0.01754000
          1.18040000          0.16345000         -0.04090500
          0.26871000          0.00000000          0.11357000
  1  0  0  1  1
          0.11774000          1.00000000
  1  0  0  1  1
          0.04468500          1.00000000
  1  0  0  1  1
          0.01576000          1.00000000
  1  1  1  3  1
          8.24000000          0.01114710
          1.79000000          0.08054940
          0.45000000          0.25574400
  1  1  1  1  1
          0.14000000          1.00000000
  1  1  1  1  1
          0.04728000          1.00000000
  1  2  2  1  1
          0.39000000          1.00000000
  1  2  2  1  1
          0.06304000          1.00000000
# BORON
B  aug-pc-2
 13
  1  0  0  8  2
       5220.40000000          0.00059530          0.00000000
        783.19000000          0.00459910          0.00000166
        178.31000000          0.02353000         -0.00006852
         50.46900000          0.09001500         -0.00068751
         16.28500000          0.24988000         -0.00736900
          5.68850000          0.44237000         -0.03709800
          2.04950000          0.34536000         -0.08698600
          0.51473000          0.00000000          0.21361000
  1  0  0  1  1
          0.21556000          1.00000000
  1  0  0  1  1
          0.07745700          1.00000000
  1  0  0  1  1
          0.02597000          1.00000000
  1  1  1  4  1
         21.81000000          0.00588410
          4.89300000          0.04179800
          1.39760000          0.15567000
          0.47747000          0.35997000
  1  1  1  1  1
          0.16419000          1.00000000
  1  1  1  1  1
          0.05400400          1.00000000
  1  1  1  1  1
          0.01667000          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.05001000          1.00000000
  1  3  3  1  1
          0.87000000          1.00000000
  1  3  3  1  1
          0.06668000          1.00000000
# CARBON
C  aug-pc-2
 13
  1  0  0  8  2
       7857.10000000          0.00056825          0.00000000
       1178.70000000          0.00439150         -0.00000059
        268.32000000          0.02250400         -0.00006275
         75.94800000          0.08665300         -0.00075773
         24.55900000          0.24405000         -0.00733080
          8.62120000          0.44148000         -0.03893200
          3.12780000          0.35332000         -0.08890800
          0.82202000          0.00000000          0.21689000
  1  0  0  1  1
          0.33017000          1.00000000
  1  0  0  1  1
          0.11463000          1.00000000
  1  0  0  1  1
          0.03721700          1.00000000
  1  1  1  4  1
         33.77500000          0.00602940
          7.67660000          0.04322800
          2.23570000          0.16301000
          0.76447000          0.36504000
  1  1  1  1  1
          0.26232000          1.00000000
  1  1  1  1  1
          0.08463800          1.00000000
  1  1  1  1  1
          0.02644900          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
  1  2  2  1  1
          0.07934800          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
  1  3  3  1  1
          0.10580000          1.00000000
# NITROGEN
N  aug-pc-2
 13
  1  0  0  8  2
      11101.00000000          0.00054570          0.00000000
       1665.30000000          0.00421810         -0.00000150
        379.08000000          0.02164500         -0.00005875
        107.30000000          0.08377600         -0.00077453
         34.74700000          0.23881000         -0.00721610
         12.24900000          0.43994000         -0.03933800
          4.47430000          0.36364000         -0.09061100
          1.24040000          0.00000000          0.19882000
  1  0  0  1  1
          0.48743000          1.00000000
  1  0  0  1  1
          0.16484000          1.00000000
  1  0  0  1  1
          0.05216500          1.00000000
  1  1  1  4  1
         47.93400000          0.00617060
         10.99900000          0.04426000
          3.24720000          0.16825000
          1.11140000          0.36848000
  1  1  1  1  1
          0.37988000          1.00000000
  1  1  1  1  1
          0.12068000          1.00000000
  1  1  1  1  1
          0.03602300          1.00000000
  1  2  2  1  1
          1.80000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.10807000          1.00000000
  1  3  3  1  1
          1.02000000          1.00000000
  1  3  3  1  1
          0.14409000          1.00000000
# OXYGEN
O  aug-pc-2
 13
  1  0  0  8  2
      14782.00000000          0.00053519          0.00000000
       2217.30000000          0.00413750         -0.00000193
        504.74000000          0.02124500         -0.00005796
        142.87000000          0.08245300         -0.00079494
         46.30000000          0.23671000         -0.00731250
         16.33700000          0.44039000         -0.04057400
          5.98280000          0.36465000         -0.09159400
          1.67180000          0.00000000          0.20940000
  1  0  0  1  1
          0.64662000          1.00000000
  1  0  0  1  1
          0.21669000          1.00000000
  1  0  0  1  1
          0.06814100          1.00000000
  1  1  1  4  1
         60.42400000          0.00689490
         13.93500000          0.04900500
          4.15310000          0.18255000
          1.41580000          0.37633000
  1  1  1  1  1
          0.47549000          1.00000000
  1  1  1  1  1
          0.14529000          1.00000000
  1  1  1  1  1
          0.04187100          1.00000000
  1  2  2  1  1
          2.20000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.12561000          1.00000000
  1  3  3  1  1
          1.10000000          1.00000000
  1  3  3  1  1
          0.16748000          1.00000000
# FLUORINE
F  aug-pc-2
 13
  1  0  0  8  2
      19127.00000000          0.00052250          0.00000000
       2868.90000000          0.00404000         -0.00000226
        653.04000000          0.02075900         -0.00005664
        184.85000000          0.08080000         -0.00079782
         59.94900000          0.23362000         -0.00727130
         21.19000000          0.43965000         -0.04083100
          7.78460000          0.37041000         -0.09293100
          2.23050000          0.00000000          0.20228000
  1  0  0  1  1
          0.85409000          1.00000000
  1  0  0  1  1
          0.28336000          1.00000000
  1  0  0  1  1
          0.08827600          1.00000000
  1  1  1  4  1
         77.63900000          0.00703130
         17.96500000          0.05013700
          5.40050000          0.18553000
          1.84230000          0.37546000
  1  1  1  1  1
          0.61532000          1.00000000
  1  1  1  1  1
          0.18489000          1.00000000
  1  1  1  1  1
          0.05237600          1.00000000
  1  2  2  1  1
          2.80000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.15713000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
  1  3  3  1  1
          0.20951000          1.00000000
# NEON
Ne aug-pc-2
 13
  1  0  0  8  2
      23880.00000000          0.00025835          0.00000000
       3581.70000000          0.00199770         -0.00000765
        815.27000000          0.01026900         -0.00013638
        230.77000000          0.04003600         -0.00206690
         74.88400000          0.11619000         -0.01814000
         26.51800000          0.21959000         -0.10379000
          9.76920000          0.18608000         -0.23283000
          2.83050000          0.00000000          0.50798000
  1  0  0  1  1
          1.07400000          1.00000000
  1  0  0  1  1
          0.35400000          1.00000000
  1  0  0  1  1
          0.10950000          1.00000000
  1  1  1  4  1
         97.10600000          0.00356680
         22.54300000          0.02546700
          6.81730000          0.09401600
          2.32630000          0.18796000
  1  1  1  1  1
          0.77425000          1.00000000
  1  1  1  1  1
          0.23026000          1.00000000
  1  1  1  1  1
          0.06462000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          0.85000000          1.00000000
  1  2  2  1  1
          0.19390000          1.00000000
  1  3  3  1  1
          1.30000000          1.00000000
  1  3  3  1  1
          0.25850000          1.00000000
# SODIUM
Na aug-pc-2
 10
  1  0  0 11  3
      64474.00000000          0.00019020          0.00000000          0.00000000
       9667.50000000          0.00147490          0.00000000          0.00000000
       2200.80000000          0.00767780         -0.00001388          0.00000450
        623.26000000          0.03133300         -0.00014242          0.00005447
        203.12000000          0.10269000         -0.00181590          0.00061058
         72.94400000          0.25598000         -0.01209300          0.00417240
         28.02600000          0.41517000         -0.05682300          0.01823100
         11.05500000          0.30473000         -0.10110000          0.02901700
          3.54900000          0.04114600          0.22498000         -0.05293200
          1.40820000          0.00000000          0.51711000          0.16965000
          0.51148000          0.00000000          0.00000000          0.88478000
  1  0  0  1  1
          0.06953400          1.00000000
  1  0  0  1  1
          0.02512000          1.00000000
  1  0  0  1  1
          0.00846300          1.00000000
  1  1  1  7  1
        230.53000000          0.00254200
         54.20100000          0.01976800
         17.40200000          0.08348000
          6.31520000          0.23282000
          2.40840000          0.38216000
          0.90249000          0.37985000
          0.31450000          0.16287000
  1  1  1  1  1
          0.12100000          1.00000000
  1  1  1  1  1
          0.03900000          1.00000000
  1  1  1  1  1
          0.01300000          1.00000000
  1  2  2  1  1
          0.24000000          1.00000000
  1  2  2  1  1
          0.03385000          1.00000000
# MAGNESIUM
Mg aug-pc-2
 10
  1  0  0 11  3
      81017.00000000          0.00008905          0.00000000          0.00000000
      12143.00000000          0.00069088         -0.00000052          0.00000000
       2763.80000000          0.00359990         -0.00000408         -0.00001191
        782.58000000          0.01472100         -0.00008248         -0.00014781
        255.03000000          0.04857200         -0.00070727         -0.00168720
         91.62300000          0.12279000         -0.00549130         -0.01186400
         35.24500000          0.20506000         -0.02385900         -0.05598300
         13.96000000          0.15913000         -0.04982700         -0.11311000
          4.74220000          0.02509900          0.08349700          0.18789000
          1.92840000          0.00000000          0.19563000          0.71752000
          0.72424000          0.00000000          0.00000000          0.53956000
  1  0  0  1  1
          0.12353000          1.00000000
  1  0  0  1  1
          0.04303200          1.00000000
  1  0  0  1  1
          0.01401000          1.00000000
  1  1  1  7  1
        309.05000000          0.00111300
         72.89400000          0.00875690
         23.49400000          0.03825400
          8.56190000          0.11095000
          3.30680000          0.19174000
          1.26940000          0.19457000
          0.46106000          0.07820400
  1  1  1  1  1
          0.17700000          1.00000000
  1  1  1  1  1
          0.05700000          1.00000000
  1  1  1  1  1
          0.01900000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.05605000          1.00000000
# ALUMINUM
Al aug-pc-2
 13
  1  0  0 11  3
      99741.00000000          0.00016809          0.00000000          0.00000000
      14949.00000000          0.00130410         -0.00000048          0.00000000
       3402.50000000          0.00679790         -0.00000205         -0.00000556
        963.53000000          0.02784000         -0.00005573         -0.00006905
        314.05000000          0.09235800         -0.00041853         -0.00079085
        112.88000000          0.23633000         -0.00348130         -0.00564140
         43.47400000          0.40484000         -0.01486400         -0.02728800
         17.29200000          0.32992000         -0.03401200         -0.05953800
          6.16220000          0.05852100          0.04389600          0.07239300
          2.52260000          0.00000000          0.11958000          0.41226000
          0.96874000          0.00000000          0.00000000          0.39165000
  1  0  0  1  1
          0.19251000          1.00000000
  1  0  0  1  1
          0.06781300          1.00000000
  1  0  0  1  1
          0.02231000          1.00000000
  1  1  1  8  2
        579.71000000          0.00105610          0.00000000
        137.54000000          0.00863350          0.00002967
         44.06700000          0.04322700         -0.00010593
         16.14800000          0.14168000         -0.00017370
          6.48880000          0.30352000         -0.00443150
          2.66320000          0.40389000         -0.00441340
          1.07920000          0.28642000         -0.00107230
          0.39771000          0.00000000          0.17650000
  1  1  1  1  1
          0.13475000          1.00000000
  1  1  1  1  1
          0.04218500          1.00000000
  1  1  1  1  1
          0.01243000          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.33000000          1.00000000
  1  2  2  1  1
          0.03729000          1.00000000
  1  3  3  1  1
          0.48000000          1.00000000
  1  3  3  1  1
          0.04972000          1.00000000
# SILICON
Si aug-pc-2
 13
  1  0  0 11  3
     120040.00000000          0.00016075          0.00000000          0.00000000
      17991.00000000          0.00124720         -0.00000068          0.00000000
       4094.80000000          0.00650400         -0.00000211         -0.00000399
       1159.60000000          0.02666500         -0.00006916         -0.00005020
        378.00000000          0.08881600         -0.00048080         -0.00057553
        135.93000000          0.22932000         -0.00416940         -0.00415240
         52.41100000          0.40025000         -0.01767400         -0.02043700
         20.92700000          0.33828000         -0.04289100         -0.04699800
          7.71300000          0.06551200          0.04536800          0.04398600
          3.16040000          0.00000000          0.13904000          0.33957000
          1.23480000          0.00000000          0.00000000          0.35038000
  1  0  0  1  1
          0.26775000          1.00000000
  1  0  0  1  1
          0.09406700          1.00000000
  1  0  0  1  1
          0.03087800          1.00000000
  1  1  1  8  2
        677.13000000          0.00109250          0.00000000
        160.67000000          0.00896010          0.00000790
         51.58500000          0.04474400         -0.00013613
         18.94800000          0.14748000         -0.00090378
          7.61630000          0.31480000         -0.00558630
          3.13170000          0.41339000         -0.01014100
          1.27030000          0.26440000          0.01866100
          0.43332000          0.00000000          0.28890000
  1  1  1  1  1
          0.16088000          1.00000000
  1  1  1  1  1
          0.05488300          1.00000000
  1  1  1  1  1
          0.01752700          1.00000000
  1  2  2  1  1
          1.68000000          1.00000000
  1  2  2  1  1
          0.38000000          1.00000000
  1  2  2  1  1
          0.05258000          1.00000000
  1  3  3  1  1
          0.54000000          1.00000000
  1  3  3  1  1
          0.07010700          1.00000000
# PHOSPHOROUS
P  aug-pc-2
 13
  1  0  0 11  3
     145680.00000000          0.00015016          0.00000000          0.00000000
      21836.00000000          0.00116500         -0.00000105          0.00000000
       4969.90000000          0.00607980         -0.00000168         -0.00000249
       1407.30000000          0.02496800         -0.00008760         -0.00003095
        458.78000000          0.08363700         -0.00052745         -0.00035776
        165.08000000          0.21863000         -0.00495750         -0.00261230
         63.74400000          0.39234000         -0.02053500         -0.01320400
         25.59800000          0.35038000         -0.05503000         -0.03284800
          9.93070000          0.07728700          0.04158300          0.01818200
          3.96860000          0.00000000          0.17029000          0.25722000
          1.55650000          0.00000000          0.00000000          0.30682000
  1  0  0  1  1
          0.35404000          1.00000000
  1  0  0  1  1
          0.12394000          1.00000000
  1  0  0  1  1
          0.04054800          1.00000000
  1  1  1  8  2
        826.23000000          0.00102250          0.00000000
        196.02000000          0.00844720          0.00000411
         62.95100000          0.04266400         -0.00015057
         23.22200000          0.14239000         -0.00111410
          9.38850000          0.31059000         -0.00649420
          3.89970000          0.41672000         -0.01246900
          1.60480000          0.26618000          0.02345800
          0.56053000          0.00000000          0.32270000
  1  1  1  1  1
          0.21175000          1.00000000
  1  1  1  1  1
          0.07348600          1.00000000
  1  1  1  1  1
          0.02384800          1.00000000
  1  2  2  1  1
          1.89000000          1.00000000
  1  2  2  1  1
          0.43000000          1.00000000
  1  2  2  1  1
          0.07154300          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
  1  3  3  1  1
          0.09539000          1.00000000
# SULFUR
S  aug-pc-2
 13
  1  0  0 11  3
     172030.00000000          0.00014353          0.00000000          0.00000000
      25783.00000000          0.00111370         -0.00000119          0.00000000
       5868.20000000          0.00581430         -0.00000123         -0.00000220
       1661.70000000          0.02390300         -0.00009048         -0.00002837
        541.75000000          0.08035400         -0.00050105         -0.00032591
        195.01000000          0.21175000         -0.00495100         -0.00241310
         75.39600000          0.38664000         -0.02025200         -0.01235200
         30.40700000          0.35747000         -0.05738800         -0.03211900
         12.12100000          0.08613100          0.03484700          0.01161100
          4.77770000          0.00000000          0.16833000          0.25542000
          1.89060000          0.00000000          0.00000000          0.31384000
  1  0  0  1  1
          0.44686000          1.00000000
  1  0  0  1  1
          0.15621000          1.00000000
  1  0  0  1  1
          0.05103700          1.00000000
  1  1  1  8  2
        968.12000000          0.00100480          0.00000000
        229.70000000          0.00833130         -0.00000807
         73.83300000          0.04226000         -0.00016943
         27.31200000          0.14206000         -0.00152430
         11.07400000          0.31256000         -0.00719930
          4.63070000          0.41933000         -0.01611300
          1.92990000          0.25924000          0.03423400
          0.68783000          0.00000000          0.35518000
  1  1  1  1  1
          0.25663000          1.00000000
  1  1  1  1  1
          0.08725100          1.00000000
  1  1  1  1  1
          0.02777600          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  2  2  1  1
          0.08332700          1.00000000
  1  3  3  1  1
          0.66000000          1.00000000
  1  3  3  1  1
          0.11110000          1.00000000
# CHLORINE
Cl aug-pc-2
 13
  1  0  0 11  3
     201150.00000000          0.00013753          0.00000000          0.00000000
      30146.00000000          0.00106710         -0.00000134          0.00000000
       6861.00000000          0.00557370         -0.00000095         -0.00000197
       1942.80000000          0.02293500         -0.00009465         -0.00002487
        633.42000000          0.07735400         -0.00048337         -0.00028967
        228.10000000          0.20534000         -0.00500090         -0.00215130
         88.28800000          0.38093000         -0.02023000         -0.01119500
         35.75000000          0.36361000         -0.06020900         -0.03018000
         14.57100000          0.09518200          0.02919500          0.00594560
          5.65800000          0.00000000          0.16993000          0.24702000
          2.25540000          0.00000000          0.00000000          0.31412000
  1  0  0  1  1
          0.54947000          1.00000000
  1  0  0  1  1
          0.19126000          1.00000000
  1  0  0  1  1
          0.06224100          1.00000000
  1  1  1  8  2
       1129.90000000          0.00097621          0.00000000
        268.06000000          0.00812600         -0.00001160
         86.22200000          0.04143300         -0.00018289
         31.97900000          0.14035000         -0.00171700
         13.00800000          0.31207000         -0.00789740
          5.47660000          0.42099000         -0.01823700
          2.30900000          0.25664000          0.04003500
          0.84601000          0.00000000          0.36717000
  1  1  1  1  1
          0.31659000          1.00000000
  1  1  1  1  1
          0.10716000          1.00000000
  1  1  1  1  1
          0.03397000          1.00000000
  1  2  2  1  1
          2.31000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.10191000          1.00000000
  1  3  3  1  1
          0.72000000          1.00000000
  1  3  3  1  1
          0.13588000          1.00000000
# ARGON
Ar aug-pc-2
 13
  1  0  0 11  3
     232510.00000000          0.00006626          0.00000000          0.00000000
      34844.00000000          0.00051412         -0.00000706          0.00000000
       7930.30000000          0.00268610         -0.00000242         -0.00000094
       2245.70000000          0.01106200         -0.00047564         -0.00001183
        732.22000000          0.03740800         -0.00227710         -0.00013817
        263.77000000          0.09992800         -0.02452700         -0.00103240
        102.19000000          0.18788000         -0.09819400         -0.00543290
         41.52500000          0.18427000         -0.30459000         -0.01508500
         17.20200000          0.05178200          0.11940000          0.00111200
          6.59670000          0.00000000          0.83173000          0.12461000
          2.64770000          0.00000000          0.00000000          0.16083000
  1  0  0  1  1
          0.66193000          1.00000000
  1  0  0  1  1
          0.22901000          1.00000000
  1  0  0  1  1
          0.07411000          1.00000000
  1  1  1  8  2
       1297.70000000          0.00047997          0.00000000
        307.86000000          0.00400670         -0.00000664
         99.09600000          0.02049700         -0.00009881
         36.83700000          0.06981900         -0.00093571
         15.02700000          0.15625000         -0.00431330
          6.36620000          0.21099000         -0.00986480
          2.71100000          0.12665000          0.02233400
          1.01820000          0.00000000          0.18833000
  1  1  1  1  1
          0.38274000          1.00000000
  1  1  1  1  1
          0.12946000          1.00000000
  1  1  1  1  1
          0.04101000          1.00000000
  1  2  2  1  1
          2.52000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  2  2  1  1
          0.12300000          1.00000000
  1  3  3  1  1
          0.78000000          1.00000000
  1  3  3  1  1
          0.16400000          1.00000000
#  aug-pc-3  EMSL  Basis Set Exchange Library  6/6/08 12:18 AM
# Elements                             References
# --------                             ----------
# :  .
#
# HYDROGEN
H  aug-pc-3
 16
  1  0  0  5  1
        774.69000000          0.00131630
        116.16000000          0.01022600
         26.44900000          0.05362900
          7.50150000          0.22285000
          2.45680000          0.75374000
  1  0  0  1  1
          0.88774000          1.00000000
  1  0  0  1  1
          0.34085000          1.00000000
  1  0  0  1  1
          0.13477000          1.00000000
  1  0  0  1  1
          0.05226300          1.00000000
  1  0  0  1  1
          0.01880000          1.00000000
  1  1  1  1  1
          6.50000000          1.00000000
  1  1  1  1  1
          1.55000000          1.00000000
  1  1  1  1  1
          0.55000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  1  1  1  1
          0.05639900          1.00000000
  1  2  2  1  1
          1.95000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.07519900          1.00000000
  1  3  3  1  1
          2.20000000          1.00000000
  1  3  3  1  1
          0.09399900          1.00000000
# HELIUM
He aug-pc-3
 16
  1  0  0  5  1
       2167.40000000          0.00084153
        324.99000000          0.00652740
         73.99400000          0.03399500
         20.97500000          0.13811000
          6.84520000          0.44195000
  1  0  0  1  1
          2.43940000          1.00000000
  1  0  0  1  1
          0.90251000          1.00000000
  1  0  0  1  1
          0.33313000          1.00000000
  1  0  0  1  1
          0.12413000          1.00000000
  1  0  0  1  1
          0.04304000          1.00000000
  1  1  1  1  1
         10.70000000          1.00000000
  1  1  1  1  1
          2.55000000          1.00000000
  1  1  1  1  1
          0.90000000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  1  1  1  1
          0.12910000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.07000000          1.00000000
  1  2  2  1  1
          0.17220000          1.00000000
  1  3  3  1  1
          3.20000000          1.00000000
  1  3  3  1  1
          0.21520000          1.00000000
# LITHIUM
Li aug-pc-3
 15
  1  0  0 10  2
      13018.00000000          0.00005145          0.00000000
       1950.10000000          0.00039716          0.00000153
        443.84000000          0.00210140         -0.00000310
        125.76000000          0.00864300          0.00005703
         41.09400000          0.03057700         -0.00003847
         14.88200000          0.08539700          0.00143160
          5.80750000          0.19415000          0.00164970
          2.38910000          0.28592000          0.02368500
          1.01840000          0.30530000          0.02024700
          0.44404000          0.00000000          0.10064000
  1  0  0  1  1
          0.19405000          1.00000000
  1  0  0  1  1
          0.08403900          1.00000000
  1  0  0  1  1
          0.03792100          1.00000000
  1  0  0  1  1
          0.01664000          1.00000000
  1  0  0  1  1
          0.00671300          1.00000000
  1  1  1  4  1
         15.40000000          0.00102953
          3.59000000          0.00833218
          1.09000000          0.02929890
          0.35000000          0.11954800
  1  1  1  1  1
          0.13000000          1.00000000
  1  1  1  1  1
          0.05000000          1.00000000
  1  1  1  1  1
          0.02014000          1.00000000
  1  2  2  1  1
          0.48000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.02685000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.03357000          1.00000000
# BERYLLIUM
Be aug-pc-3
 15
  1  0  0 10  2
      26673.00000000          0.00002197          0.00000000
       3996.30000000          0.00016954          0.00000493
        909.67000000          0.00089757         -0.00000913
        257.77000000          0.00369380          0.00019440
         84.23400000          0.01314100          0.00000956
         30.54500000          0.03717900          0.00570280
         12.02000000          0.08599900          0.01234400
          5.04950000          0.13048000          0.10403000
          2.17190000          0.13871000          0.18882000
          0.93410000          0.00000000          0.42111000
  1  0  0  1  1
          0.38918000          1.00000000
  1  0  0  1  1
          0.17402000          1.00000000
  1  0  0  1  1
          0.07602800          1.00000000
  1  0  0  1  1
          0.03226500          1.00000000
  1  0  0  1  1
          0.01262000          1.00000000
  1  1  1  4  1
         27.80000000          0.00146992
          6.46000000          0.01290300
          1.96000000          0.04633670
          0.63000000          0.18363000
  1  1  1  1  1
          0.24000000          1.00000000
  1  1  1  1  1
          0.09000000          1.00000000
  1  1  1  1  1
          0.03780000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.05040000          1.00000000
  1  3  3  1  1
          0.55000000          1.00000000
  1  3  3  1  1
          0.06300000          1.00000000
# BORON
B  aug-pc-3
 22
  1  0  0 10  2
      57415.00000000          0.00002984          0.00000000
       8601.50000000          0.00023044          0.00000428
       1957.80000000          0.00121950         -0.00000707
        554.61000000          0.00504630          0.00017669
        181.05000000          0.01812300          0.00013538
         65.49100000          0.05331800          0.00601230
         25.59900000          0.13277000          0.01984700
         10.53200000          0.23069000          0.14467000
          4.44650000          0.25545000          0.39360000
          1.88320000          0.00000000          0.80698000
  1  0  0  1  1
          0.69831000          1.00000000
  1  0  0  1  1
          0.34310000          1.00000000
  1  0  0  1  1
          0.14276000          1.00000000
  1  0  0  1  1
          0.05815700          1.00000000
  1  0  0  1  1
          0.02191000          1.00000000
  1  1  1  5  1
         90.11100000          0.00055817
         21.16500000          0.00455240
          6.56180000          0.02231300
          2.56460000          0.05947100
          1.05100000          0.16256000
  1  1  1  1  1
          0.45193000          1.00000000
  1  1  1  1  1
          0.19468000          1.00000000
  1  1  1  1  1
          0.08321200          1.00000000
  1  1  1  1  1
          0.03329700          1.00000000
  1  1  1  1  1
          0.01234000          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.05000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.03701000          1.00000000
  1  3  3  1  1
          1.20000000          1.00000000
  1  3  3  1  1
          0.52000000          1.00000000
  1  3  3  1  1
          0.04935000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
  1  4  4  1  1
          0.06168000          1.00000000
# CARBON
C  aug-pc-3
 22
  1  0  0 10  2
      87141.00000000          0.00002818          0.00000000
      13052.00000000          0.00021819          0.00000259
       2970.60000000          0.00115110         -0.00000309
        841.46000000          0.00478590          0.00012247
        274.59000000          0.01713400          0.00025494
         99.21500000          0.05112000          0.00512540
         38.69400000          0.12805000          0.02195500
         15.91100000          0.22773000          0.14112000
          6.76680000          0.24758000          0.41303000
          2.89840000          0.00000000          0.82714000
  1  0  0  1  1
          1.12460000          1.00000000
  1  0  0  1  1
          0.51446000          1.00000000
  1  0  0  1  1
          0.21176000          1.00000000
  1  0  0  1  1
          0.08501700          1.00000000
  1  0  0  1  1
          0.03160500          1.00000000
  1  1  1  5  1
        148.24000000          0.00050756
         34.91200000          0.00421260
         10.89400000          0.02133500
          4.19340000          0.06232900
          1.71340000          0.16642000
  1  1  1  1  1
          0.73566000          1.00000000
  1  1  1  1  1
          0.31637000          1.00000000
  1  1  1  1  1
          0.13242000          1.00000000
  1  1  1  1  1
          0.05190100          1.00000000
  1  1  1  1  1
          0.01887300          1.00000000
  1  2  2  1  1
          5.20000000          1.00000000
  1  2  2  1  1
          1.35000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.05661900          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  3  3  1  1
          0.65000000          1.00000000
  1  3  3  1  1
          0.07549200          1.00000000
  1  4  4  1  1
          1.40000000          1.00000000
  1  4  4  1  1
          0.09436500          1.00000000
# NITROGEN
N  aug-pc-3
 22
  1  0  0 10  2
     124550.00000000          0.00002667          0.00000000
      18656.00000000          0.00020684          0.00000141
       4245.10000000          0.00108930          0.00000000
       1202.10000000          0.00454630          0.00008144
        392.14000000          0.01623700          0.00032439
        141.58000000          0.04895700          0.00436210
         55.13600000          0.12317000          0.02283800
         22.64300000          0.22425000          0.13462000
          9.65660000          0.23876000          0.42501000
          4.16850000          0.00000000          0.82517000
  1  0  0  1  1
          1.66780000          1.00000000
  1  0  0  1  1
          0.74574000          1.00000000
  1  0  0  1  1
          0.30516000          1.00000000
  1  0  0  1  1
          0.12089000          1.00000000
  1  0  0  1  1
          0.04444400          1.00000000
  1  1  1  5  1
        218.29000000          0.00048281
         51.48800000          0.00404200
         16.13000000          0.02094600
          6.13070000          0.06475700
          2.50520000          0.17042000
  1  1  1  1  1
          1.07300000          1.00000000
  1  1  1  1  1
          0.45838000          1.00000000
  1  1  1  1  1
          0.18948000          1.00000000
  1  1  1  1  1
          0.07335900          1.00000000
  1  1  1  1  1
          0.02638800          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          1.65000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.07916400          1.00000000
  1  3  3  1  1
          1.80000000          1.00000000
  1  3  3  1  1
          0.77000000          1.00000000
  1  3  3  1  1
          0.10555000          1.00000000
  1  4  4  1  1
          1.50000000          1.00000000
  1  4  4  1  1
          0.13194000          1.00000000
# OXYGEN
O  aug-pc-3
 22
  1  0  0 10  2
     164030.00000000          0.00002652          0.00000000
      24567.00000000          0.00020571          0.00000133
       5591.00000000          0.00108270          0.00000000
       1583.60000000          0.00451900          0.00008025
        516.67000000          0.01613500          0.00034512
        186.56000000          0.04871600          0.00444840
         72.69600000          0.12268000          0.02360100
         29.99200000          0.22189000          0.13861000
         12.89900000          0.23904000          0.42872000
          5.61350000          0.00000000          0.84873000
  1  0  0  1  1
          2.29860000          1.00000000
  1  0  0  1  1
          0.99980000          1.00000000
  1  0  0  1  1
          0.40746000          1.00000000
  1  0  0  1  1
          0.15922000          1.00000000
  1  0  0  1  1
          0.05769000          1.00000000
  1  1  1  5  1
        272.02000000          0.00054941
         64.24300000          0.00458340
         20.24900000          0.02357300
          7.64380000          0.07433800
          3.12320000          0.18755000
  1  1  1  1  1
          1.32510000          1.00000000
  1  1  1  1  1
          0.55551000          1.00000000
  1  1  1  1  1
          0.22229000          1.00000000
  1  1  1  1  1
          0.08401000          1.00000000
  1  1  1  1  1
          0.02947700          1.00000000
  1  2  2  1  1
          7.00000000          1.00000000
  1  2  2  1  1
          2.00000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.08843100          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.11791000          1.00000000
  1  4  4  1  1
          1.60000000          1.00000000
  1  4  4  1  1
          0.14739000          1.00000000
# FLUORINE
F  aug-pc-3
 22
  1  0  0 10  2
     215660.00000000          0.00002538          0.00000000
      32299.00000000          0.00019693          0.00000102
       7350.40000000          0.00103600          0.00000000
       2081.80000000          0.00432940          0.00006810
        679.09000000          0.01546200          0.00034620
        245.10000000          0.04690300          0.00413970
         95.46200000          0.11881000          0.02307300
         39.42200000          0.21711000          0.13395000
         17.01800000          0.23699000          0.42246000
          7.45250000          0.00000000          0.85999000
  1  0  0  1  1
          3.13290000          1.00000000
  1  0  0  1  1
          1.33950000          1.00000000
  1  0  0  1  1
          0.54218000          1.00000000
  1  0  0  1  1
          0.20904000          1.00000000
  1  0  0  1  1
          0.07492400          1.00000000
  1  1  1  5  1
        351.22000000          0.00055263
         82.97800000          0.00462850
         26.26700000          0.02380200
          9.93070000          0.07626200
          4.06700000          0.18964000
  1  1  1  1  1
          1.72460000          1.00000000
  1  1  1  1  1
          0.71976000          1.00000000
  1  1  1  1  1
          0.28624000          1.00000000
  1  1  1  1  1
          0.10789000          1.00000000
  1  1  1  1  1
          0.03785600          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.11357000          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.05000000          1.00000000
  1  3  3  1  1
          0.15142000          1.00000000
  1  4  4  1  1
          1.70000000          1.00000000
  1  4  4  1  1
          0.18928000          1.00000000
# NEON
Ne aug-pc-3
 22
  1  0  0 10  2
     270660.00000000          0.00001247          0.00000000
      40541.00000000          0.00009678          0.00000000
       9226.50000000          0.00050863          0.00000065
       2613.20000000          0.00212860          0.00002741
        852.39000000          0.00759220          0.00018661
        307.61000000          0.02311600          0.00194920
        119.76000000          0.05861400          0.01177300
         49.43700000          0.10807000          0.06614600
         21.36900000          0.11660000          0.21457000
          9.39210000          0.00000000          0.42987000
  1  0  0  1  1
          3.98320000          1.00000000
  1  0  0  1  1
          1.68870000          1.00000000
  1  0  0  1  1
          0.68030000          1.00000000
  1  0  0  1  1
          0.26024000          1.00000000
  1  0  0  1  1
          0.09248000          1.00000000
  1  1  1  5  1
        443.45000000          0.00274680
        104.82000000          0.02308100
         33.25500000          0.11930000
         12.54800000          0.38863000
          5.14210000          0.95790000
  1  1  1  1  1
          2.17830000          1.00000000
  1  1  1  1  1
          0.90645000          1.00000000
  1  1  1  1  1
          0.35994000          1.00000000
  1  1  1  1  1
          0.13515000          1.00000000
  1  1  1  1  1
          0.04721000          1.00000000
  1  2  2  1  1
         10.00000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.15000000          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          0.14160000          1.00000000
  1  3  3  1  1
          2.80000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.18880000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
  1  4  4  1  1
          0.23600000          1.00000000
# SODIUM
Na aug-pc-3
 15
  1  0  0 14  3
     421840.00000000          0.00001821          0.00000000          0.00000000
      63188.00000000          0.00014153          0.00000000          0.00000000
      14381.00000000          0.00074380          0.00000000          0.00000000
       4073.70000000          0.00312730         -0.00000659          0.00000000
       1329.10000000          0.01124900         -0.00001064         -0.00000126
        479.99000000          0.03529200         -0.00026565         -0.00001103
        187.36000000          0.09539000         -0.00112860         -0.00007692
         77.77000000          0.21001000         -0.00804960         -0.00043274
         33.79900000          0.34417000         -0.02603700         -0.00169970
         15.12700000          0.32701000         -0.07062200         -0.00435420
          6.93200000          0.12122000         -0.01221700         -0.00178400
          2.76510000          0.00644090          0.26047000          0.02523700
          1.13970000          0.00000000          0.35925000          0.07668600
          0.45213000          0.00000000          0.00000000          0.11132000
  1  0  0  1  1
          0.08260300          1.00000000
  1  0  0  1  1
          0.04151000          1.00000000
  1  0  0  1  1
          0.01861800          1.00000000
  1  0  0  1  1
          0.00765800          1.00000000
  1  1  1  9  1
       1156.80000000          0.00015835
        274.42000000          0.00137160
         89.13900000          0.00740860
         33.25900000          0.03121400
         13.55700000          0.09092000
          5.96240000          0.20137000
          2.68240000          0.30732000
          1.19710000          0.33347000
          0.51789000          0.22947000
  1  1  1  1  1
          0.21331000          1.00000000
  1  1  1  1  1
          0.10000000          1.00000000
  1  1  1  1  1
          0.03700000          1.00000000
  1  1  1  1  1
          0.01233000          1.00000000
  1  2  2  1  1
          0.91000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  2  2  1  1
          0.03063000          1.00000000
  1  3  3  1  1
          0.27000000          1.00000000
  1  3  3  1  1
          0.03829000          1.00000000
# MAGNESIUM
Mg aug-pc-3
 15
  1  0  0 14  3
     564790.00000000          0.00000788          0.00000000          0.00000000
      84589.00000000          0.00006122          0.00000000          0.00000000
      19251.00000000          0.00032179          0.00000000          0.00000000
       5452.80000000          0.00135380         -0.00000299          0.00000000
       1779.10000000          0.00487800         -0.00000639          0.00000380
        642.58000000          0.01537600         -0.00013096          0.00003105
        250.92000000          0.04208100         -0.00060781          0.00022284
        104.19000000          0.09518700         -0.00421360          0.00120920
         45.27500000          0.16414000         -0.01490900          0.00476660
         20.31800000          0.17119000         -0.04186800          0.01026900
          9.33190000          0.07662600         -0.02166700          0.00471000
          3.69780000          0.00637870          0.14599000         -0.01339800
          1.57250000          0.00000000          0.20166000          0.23482000
          0.64949000          0.00000000          0.00000000          0.48791000
  1  0  0  1  1
          0.15901000          1.00000000
  1  0  0  1  1
          0.07166500          1.00000000
  1  0  0  1  1
          0.02994200          1.00000000
  1  0  0  1  1
          0.01155000          1.00000000
  1  1  1  9  1
       1516.90000000          0.00007161
        359.79000000          0.00062314
        116.76000000          0.00341360
         43.58000000          0.01453100
         17.92600000          0.04287000
          7.93560000          0.09778900
          3.60380000          0.15457000
          1.64410000          0.16828000
          0.74112000          0.11333000
  1  1  1  1  1
          0.31666000          1.00000000
  1  1  1  1  1
          0.14900000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  1  1  1  1
          0.01833000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.04619000          1.00000000
  1  3  3  1  1
          0.33000000          1.00000000
  1  3  3  1  1
          0.05774500          1.00000000
# ALUMINUM
Al aug-pc-3
 20
  1  0  0 14  3
     721490.00000000          0.00001419          0.00000000          0.00000000
     108090.00000000          0.00011026          0.00000000          0.00000000
      24605.00000000          0.00057946          0.00000000          0.00000000
       6971.40000000          0.00243790         -0.00000493          0.00000000
       2274.90000000          0.00879450         -0.00000863         -0.00000016
        821.60000000          0.02782100         -0.00020373         -0.00000132
        320.78000000          0.07681600         -0.00091455         -0.00000982
        133.15000000          0.17710000         -0.00657840         -0.00006244
         57.81700000          0.31603000         -0.02395500         -0.00030825
         25.95400000          0.35108000         -0.07103100         -0.00125880
         11.89900000          0.17619000         -0.05045400         -0.00186120
          4.74990000          0.01826800          0.22311000          0.01120900
          2.06880000          0.00000000          0.34708000          0.08354100
          0.87779000          0.00000000          0.00000000          0.13466000
  1  0  0  1  1
          0.24951000          1.00000000
  1  0  0  1  1
          0.11462000          1.00000000
  1  0  0  1  1
          0.04819300          1.00000000
  1  0  0  1  1
          0.01869000          1.00000000
  1  1  1 10  2
       2019.70000000          0.00012156          0.00000000
        478.63000000          0.00106070          0.00005424
        155.02000000          0.00593650         -0.00003765
         57.90400000          0.02538200          0.00089364
         24.14000000          0.07618800         -0.00359030
         10.78900000          0.17997000         -0.00368970
          4.97300000          0.30275000         -0.05406900
          2.31610000          0.34478000         -0.03337300
          1.07910000          0.23763000          0.00454730
          0.49159000          0.00000000          0.87054000
  1  1  1  1  1
          0.20482000          1.00000000
  1  1  1  1  1
          0.07925600          1.00000000
  1  1  1  1  1
          0.02892800          1.00000000
  1  1  1  1  1
          0.00983900          1.00000000
  1  2  2  1  1
          5.60000000          1.00000000
  1  2  2  1  1
          1.47000000          1.00000000
  1  2  2  1  1
          0.44000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  2  2  1  1
          0.02952000          1.00000000
  1  3  3  1  1
          0.96000000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  3  3  1  1
          0.03936000          1.00000000
  1  4  4  1  1
          0.58000000          1.00000000
  1  4  4  1  1
          0.04920000          1.00000000
# SILICON
Si aug-pc-3
 20
  1  0  0 14  3
     877450.00000000          0.00001340          0.00000000          0.00000000
     131450.00000000          0.00010407          0.00000000          0.00000000
      29929.00000000          0.00054678          0.00000000          0.00000000
       8480.20000000          0.00230100         -0.00000422          0.00000000
       2767.20000000          0.00830540         -0.00000634         -0.00000118
        999.40000000          0.02632200         -0.00016910         -0.00001035
        390.14000000          0.07303300         -0.00073715         -0.00007432
        161.91000000          0.17010000         -0.00544610         -0.00043713
         70.30400000          0.30891000         -0.02001000         -0.00193740
         31.57900000          0.35473000         -0.06137300         -0.00585630
         14.48000000          0.18872000         -0.04900200         -0.00683610
          5.83830000          0.02195300          0.17627000          0.02787000
          2.59460000          0.00000000          0.30080000          0.12767000
          1.12500000          0.00000000          0.00000000          0.17422000
  1  0  0  1  1
          0.35356000          1.00000000
  1  0  0  1  1
          0.16160000          1.00000000
  1  0  0  1  1
          0.06726100          1.00000000
  1  0  0  1  1
          0.02610500          1.00000000
  1  1  1 10  2
       2303.10000000          0.00013105          0.00000000
        545.84000000          0.00114650          0.00000612
        177.05000000          0.00636520         -0.00000590
         66.37700000          0.02719700          0.00008645
         27.60100000          0.08192500         -0.00053049
         12.34300000          0.19147000         -0.00089038
          5.68940000          0.31583000         -0.00798250
          2.64060000          0.35183000         -0.00376310
          1.20940000          0.21292000          0.01078700
          0.52013000          0.00000000          0.18186000
  1  1  1  1  1
          0.23256000          1.00000000
  1  1  1  1  1
          0.09814100          1.00000000
  1  1  1  1  1
          0.03836000          1.00000000
  1  1  1  1  1
          0.01456000          1.00000000
  1  2  2  1  1
          6.66000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.52000000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  2  2  1  1
          0.04368000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.38000000          1.00000000
  1  3  3  1  1
          0.05824000          1.00000000
  1  4  4  1  1
          0.65000000          1.00000000
  1  4  4  1  1
          0.07280000          1.00000000
# PHOSPHOROUS
P  aug-pc-3
 20
  1  0  0 14  3
    1063700.00000000          0.00001251          0.00000000          0.00000000
     160000.00000000          0.00009667          0.00000000          0.00000000
      36513.00000000          0.00050682          0.00000000          0.00000000
      10359.00000000          0.00213100         -0.00000345          0.00000000
       3382.80000000          0.00769250         -0.00000534         -0.00000176
       1222.30000000          0.02442100         -0.00013814         -0.00001580
        477.30000000          0.06812200         -0.00060882         -0.00011353
        198.09000000          0.16069000         -0.00450640         -0.00067329
         85.99400000          0.29867000         -0.01707100         -0.00303140
         38.62700000          0.35878000         -0.05395400         -0.00922920
         17.68800000          0.20616000         -0.05149400         -0.01193600
          7.25510000          0.02738600          0.13758000          0.03572500
          3.26990000          0.00000000          0.27525000          0.15875000
          1.43130000          0.00000000          0.00000000          0.21236000
  1  0  0  1  1
          0.47047000          1.00000000
  1  0  0  1  1
          0.21289000          1.00000000
  1  0  0  1  1
          0.08774200          1.00000000
  1  0  0  1  1
          0.03340800          1.00000000
  1  1  1 10  2
       2762.20000000          0.00012618          0.00000000
        654.78000000          0.00110480          0.00000596
        212.58000000          0.00614830         -0.00000681
         79.89500000          0.02630700          0.00007451
         33.36600000          0.07986600         -0.00060664
         14.98600000          0.18840000         -0.00126040
          6.96800000          0.31362000         -0.00947190
          3.28180000          0.35326000         -0.00440140
          1.52470000          0.21366000          0.01246600
          0.66924000          0.00000000          0.21343000
  1  1  1  1  1
          0.29929000          1.00000000
  1  1  1  1  1
          0.12811000          1.00000000
  1  1  1  1  1
          0.05099200          1.00000000
  1  1  1  1  1
          0.01880000          1.00000000
  1  2  2  1  1
          7.71000000          1.00000000
  1  2  2  1  1
          2.03000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          0.22000000          1.00000000
  1  2  2  1  1
          0.05639900          1.00000000
  1  3  3  1  1
          1.34000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.07519900          1.00000000
  1  4  4  1  1
          0.72000000          1.00000000
  1  4  4  1  1
          0.09399900          1.00000000
# SULFUR
S  aug-pc-3
 20
  1  0  0 14  3
    1250400.00000000          0.00001202          0.00000000          0.00000000
     188080.00000000          0.00009294          0.00000000          0.00000000
      42918.00000000          0.00048720          0.00000000          0.00000000
      12179.00000000          0.00204790         -0.00000304          0.00000000
       3978.70000000          0.00738970         -0.00000465         -0.00000231
       1438.10000000          0.02348100         -0.00012316         -0.00001956
        561.67000000          0.06568500         -0.00054723         -0.00014386
        233.11000000          0.15597000         -0.00407020         -0.00084419
        101.22000000          0.29322000         -0.01565200         -0.00386210
         45.49300000          0.36011000         -0.05030900         -0.01181300
         20.84700000          0.21506000         -0.05151700         -0.01611400
          8.64920000          0.03078200          0.11823000          0.04149200
          3.94560000          0.00000000          0.25628000          0.18517000
          1.74720000          0.00000000          0.00000000          0.23963000
  1  0  0  1  1
          0.59953000          1.00000000
  1  0  0  1  1
          0.27127000          1.00000000
  1  0  0  1  1
          0.11080000          1.00000000
  1  0  0  1  1
          0.04183700          1.00000000
  1  1  1 10  2
       3285.80000000          0.00012062          0.00000000
        778.93000000          0.00105870          0.00000424
        252.76000000          0.00591910         -0.00000743
         95.10000000          0.02540500          0.00002773
         39.82000000          0.07785900         -0.00065028
         17.92500000          0.18578000         -0.00189330
          8.36990000          0.31347000         -0.01019100
          3.96550000          0.35718000         -0.00762910
          1.85400000          0.21179000          0.02103200
          0.81971000          0.00000000          0.24347000
  1  1  1  1  1
          0.36117000          1.00000000
  1  1  1  1  1
          0.15097000          1.00000000
  1  1  1  1  1
          0.05962000          1.00000000
  1  1  1  1  1
          0.02182000          1.00000000
  1  2  2  1  1
          8.76000000          1.00000000
  1  2  2  1  1
          2.30000000          1.00000000
  1  2  2  1  1
          0.68000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.06546100          1.00000000
  1  3  3  1  1
          1.53000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  3  3  1  1
          0.08728200          1.00000000
  1  4  4  1  1
          0.79000000          1.00000000
  1  4  4  1  1
          0.10910000          1.00000000
# CHLORINE
Cl aug-pc-3
 20
  1  0  0 14  3
    1461100.00000000          0.00001153          0.00000000          0.00000000
     219590.00000000          0.00008923          0.00000000          0.00000000
      50085.00000000          0.00046811          0.00000000          0.00000000
      14206.00000000          0.00196920         -0.00000271          0.00000000
       4638.90000000          0.00711120         -0.00000432         -0.00000287
       1676.30000000          0.02262500         -0.00010907         -0.00002495
        654.51000000          0.06348800         -0.00048853         -0.00018272
        271.53000000          0.15173000         -0.00363270         -0.00108210
        117.87000000          0.28826000         -0.01414200         -0.00498460
         52.98400000          0.36113000         -0.04616700         -0.01541400
         24.29200000          0.22303000         -0.05010700         -0.02177400
         10.18400000          0.03403100          0.09999900          0.04888100
          4.69280000          0.00000000          0.23750000          0.21808000
          2.09740000          0.00000000          0.00000000          0.27412000
  1  0  0  1  1
          0.74867000          1.00000000
  1  0  0  1  1
          0.33613000          1.00000000
  1  0  0  1  1
          0.13573000          1.00000000
  1  0  0  1  1
          0.05071100          1.00000000
  1  1  1 10  2
       3845.70000000          0.00011653          0.00000000
        911.23000000          0.00102500          0.00000358
        295.64000000          0.00574810         -0.00000778
        111.40000000          0.02470000          0.00000677
         46.76700000          0.07626300         -0.00069394
         21.10600000          0.18343000         -0.00225630
          9.90580000          0.31219000         -0.01101800
          4.73470000          0.35836000         -0.00936630
          2.23640000          0.21176000          0.02517100
          1.00710000          0.00000000          0.25574000
  1  1  1  1  1
          0.44369000          1.00000000
  1  1  1  1  1
          0.18488000          1.00000000
  1  1  1  1  1
          0.07326800          1.00000000
  1  1  1  1  1
          0.02690400          1.00000000
  1  2  2  1  1
          9.81000000          1.00000000
  1  2  2  1  1
          2.58000000          1.00000000
  1  2  2  1  1
          0.76000000          1.00000000
  1  2  2  1  1
          0.28000000          1.00000000
  1  2  2  1  1
          0.08071100          1.00000000
  1  3  3  1  1
          1.72000000          1.00000000
  1  3  3  1  1
          0.57000000          1.00000000
  1  3  3  1  1
          0.10761000          1.00000000
  1  4  4  1  1
          0.86000000          1.00000000
  1  4  4  1  1
          0.13452000          1.00000000
# ARGON
Ar aug-pc-3
 20
  1  0  0 14  3
    1702200.00000000          0.00000551          0.00000000          0.00000000
     254910.00000000          0.00004283          0.00000000          0.00000000
      58011.00000000          0.00022523          0.00000000          0.00000000
      16431.00000000          0.00094887         -0.00000120          0.00000000
       5360.50000000          0.00343160         -0.00000200         -0.00000162
       1935.40000000          0.01093900         -0.00004943         -0.00001423
        755.09000000          0.03079100         -0.00022448         -0.00010427
        313.08000000          0.07398700         -0.00166520         -0.00062078
        135.88000000          0.14187000         -0.00657890         -0.00288130
         61.09200000          0.18089000         -0.02173400         -0.00902010
         28.02400000          0.11508000         -0.02485100         -0.01322600
         11.86000000          0.01857900          0.04358600          0.02632900
          5.51170000          0.00000000          0.11336000          0.12105000
          2.48220000          0.00000000          0.00000000          0.15170000
  1  0  0  1  1
          0.91761000          1.00000000
  1  0  0  1  1
          0.40703000          1.00000000
  1  0  0  1  1
          0.16238000          1.00000000
  1  0  0  1  1
          0.05999000          1.00000000
  1  1  1 10  2
       4415.50000000          0.00005728          0.00000000
       1046.30000000          0.00050427          0.00000148
        339.54000000          0.00283210         -0.00000423
        128.10000000          0.01218600         -0.00000694
         53.82300000          0.03792400         -0.00037331
         24.30700000          0.09176200         -0.00132140
         11.44000000          0.15656000         -0.00599320
          5.51320000          0.17875000         -0.00517140
          2.63310000          0.10447000          0.01411000
          1.21090000          0.00000000          0.13276000
  1  1  1  1  1
          0.53411000          1.00000000
  1  1  1  1  1
          0.22314000          1.00000000
  1  1  1  1  1
          0.08879200          1.00000000
  1  1  1  1  1
          0.03273000          1.00000000
  1  2  2  1  1
         10.86000000          1.00000000
  1  2  2  1  1
          2.86000000          1.00000000
  1  2  2  1  1
          0.84000000          1.00000000
  1  2  2  1  1
          0.31000000          1.00000000
  1  2  2  1  1
          0.09819000          1.00000000
  1  3  3  1  1
          1.91000000          1.00000000
  1  3  3  1  1
          0.63000000          1.00000000
  1  3  3  1  1
          0.13090000          1.00000000
  1  4  4  1  1
          0.93000000          1.00000000
  1  4  4  1  1
          0.16360000          1.00000000
#  aug-pc-4  EMSL  Basis Set Exchange Library  6/6/08 12:18 AM
# Elements                             References
# --------                             ----------
# H C N O F: Frank Jensen, Polarization consistent basis sets: Principles, J. Chem. Phys. 115, 9113 (2001).
# H C N O F: Frank Jensen, Polarization consistent basis sets. II. Estimating the Kohn-Sham basis set limit, J. Chem. Phys. 116, 7372 (2002).
# Si P S Cl: Frank Jensen, Trygve Helgaker, Polarization consistent basis sets. V. The elements Si-Cl, J. Chem. Phys. 121, 3463 (2004).
# He Li Be B Ne Na Mg Al Ar: Frank Jensen, Polarization consistent basis sets. VI. The elements He, Li, Be, B, Ne, Na, Mg, Al, Ar, J. Phys. Chem. A 000, 000 (2007).
# H C N O F: Frank Jensen, Polarization consistent basis sets. III. The importance of diffuse functions, J. Chem. Phys. 117, 9234 (2002).
#
# HYDROGEN
H  aug-pc-4
 24
  1  0  0  5  1
       3079.70000000          0.00023473
        461.52000000          0.00182450
        105.06000000          0.00959330
         29.76400000          0.04046100
          9.71830000          0.14607000
  1  0  0  1  1
          3.51790000          1.00000000
  1  0  0  1  1
          1.37700000          1.00000000
  1  0  0  1  1
          0.56831000          1.00000000
  1  0  0  1  1
          0.24341000          1.00000000
  1  0  0  1  1
          0.10505000          1.00000000
  1  0  0  1  1
          0.04419800          1.00000000
  1  0  0  1  1
          0.01713100          1.00000000
  1  1  1  1  1
         30.00000000          1.00000000
  1  1  1  1  1
          6.60000000          1.00000000
  1  1  1  1  1
          2.10000000          1.00000000
  1  1  1  1  1
          0.95000000          1.00000000
  1  1  1  1  1
          0.45000000          1.00000000
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.05139300          1.00000000
  1  2  2  1  1
          2.10000000          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.06852400          1.00000000
  1  3  3  1  1
          2.50000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.08565600          1.00000000
  1  4  4  1  1
          3.20000000          1.00000000
  1  4  4  1  1
          0.10279000          1.00000000
# HELIUM
He aug-pc-4
 24
  1  0  0  5  1
       8780.20000000          0.00146640
       1315.60000000          0.01139500
        299.46000000          0.05981900
         84.83300000          0.25089000
         27.69100000          0.89135000
  1  0  0  1  1
         10.00800000          1.00000000
  1  0  0  1  1
          3.89240000          1.00000000
  1  0  0  1  1
          1.58190000          1.00000000
  1  0  0  1  1
          0.65698000          1.00000000
  1  0  0  1  1
          0.26459000          1.00000000
  1  0  0  1  1
          0.10585000          1.00000000
  1  0  0  1  1
          0.03920000          1.00000000
  1  1  1  1  1
         40.50000000          1.00000000
  1  1  1  1  1
          8.90000000          1.00000000
  1  1  1  1  1
          2.85000000          1.00000000
  1  1  1  1  1
          1.30000000          1.00000000
  1  1  1  1  1
          0.60000000          1.00000000
  1  1  1  1  1
          0.20000000          1.00000000
  1  1  1  1  1
          0.11760000          1.00000000
  1  2  2  1  1
          3.70000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.15680000          1.00000000
  1  3  3  1  1
          4.10000000          1.00000000
  1  3  3  1  1
          1.50000000          1.00000000
  1  3  3  1  1
          0.19600000          1.00000000
  1  4  4  1  1
          4.65000000          1.00000000
  1  4  4  1  1
          0.23520000          1.00000000
# LITHIUM
Li aug-pc-4
 22
  1  0  0 13  2
      70681.00000000          0.00000544          0.00000000
      13594.00000000          0.00003328         -0.00000011
       3100.40000000          0.00019175          0.00000017
        826.46000000          0.00089686         -0.00000357
        253.76000000          0.00344770          0.00000859
         88.45100000          0.01143500         -0.00005557
         34.49300000          0.03095700          0.00028213
         14.83100000          0.07323700         -0.00045594
          6.92990000          0.12668000          0.00524910
          3.46780000          0.21423000         -0.00487050
          1.83160000          0.17857000          0.04683100
          1.00630000          0.28492000         -0.03228200
          0.56678000          0.00000000          0.10296000
  1  0  0  1  1
          0.32254000          1.00000000
  1  0  0  1  1
          0.18277000          1.00000000
  1  0  0  1  1
          0.10164000          1.00000000
  1  0  0  1  1
          0.05466600          1.00000000
  1  0  0  1  1
          0.02802500          1.00000000
  1  0  0  1  1
          0.01349700          1.00000000
  1  0  0  1  1
          0.00593000          1.00000000
  1  1  1  5  1
         28.50000000          0.00036754
          6.64000000          0.00322359
          1.92000000          0.01432120
          0.77000000          0.03648140
          0.32000000          0.07577460
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.06600000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  1  1  1  1
          0.00830000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  2  2  1  1
          0.02372000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          0.02965000          1.00000000
  1  4  4  1  1
          0.55000000          1.00000000
  1  4  4  1  1
          0.03558000          1.00000000
# BERYLLIUM
Be aug-pc-4
 22
  1  0  0 13  2
     139330.00000000          0.00000244          0.00000000
      26774.00000000          0.00001494         -0.00000040
       6112.00000000          0.00008580          0.00000060
       1632.90000000          0.00040022         -0.00001224
        503.03000000          0.00152890          0.00003235
        176.03000000          0.00505860         -0.00017006
         68.93900000          0.01364400          0.00113620
         29.76800000          0.03273000         -0.00064192
         13.96300000          0.05754600          0.02159000
          7.00900000          0.10067000          0.00042561
          3.70940000          0.08634800          0.18149000
          2.03920000          0.12653000          0.01235200
          1.14720000          0.00000000          0.38475000
  1  0  0  1  1
          0.65070000          1.00000000
  1  0  0  1  1
          0.36659000          1.00000000
  1  0  0  1  1
          0.20211000          1.00000000
  1  0  0  1  1
          0.10742000          1.00000000
  1  0  0  1  1
          0.05423100          1.00000000
  1  0  0  1  1
          0.02561900          1.00000000
  1  0  0  1  1
          0.01106000          1.00000000
  1  1  1  5  1
         45.70000000          0.00065877
         10.60000000          0.00573382
          3.08000000          0.02784590
          1.23000000          0.05643490
          0.51000000          0.17616700
  1  1  1  1  1
          0.23000000          1.00000000
  1  1  1  1  1
          0.10600000          1.00000000
  1  1  1  1  1
          0.04000000          1.00000000
  1  1  1  1  1
          0.01333000          1.00000000
  1  2  2  1  1
          3.35000000          1.00000000
  1  2  2  1  1
          0.57000000          1.00000000
  1  2  2  1  1
          0.21000000          1.00000000
  1  2  2  1  1
          0.04424000          1.00000000
  1  3  3  1  1
          0.75000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          0.05530000          1.00000000
  1  4  4  1  1
          0.80000000          1.00000000
  1  4  4  1  1
          0.06636000          1.00000000
# BORON
B  aug-pc-4
 32
  1  0  0 12  2
     742500.00000000          0.00000122          0.00000000
     110930.00000000          0.00000944          0.00000000
      25203.00000000          0.00005028          0.00000000
       7129.30000000          0.00020962          0.00000231
       2324.70000000          0.00077739         -0.00000366
        839.05000000          0.00247190          0.00004948
        327.79000000          0.00746650          0.00001943
        136.72000000          0.01909500          0.00110270
         60.29400000          0.04670600          0.00268300
         27.73100000          0.08501500          0.02218600
         12.99200000          0.14297000          0.06084500
          6.25510000          0.00000000          0.28114000
  1  0  0  1  1
          3.14720000          1.00000000
  1  0  0  1  1
          1.56270000          1.00000000
  1  0  0  1  1
          0.74066000          1.00000000
  1  0  0  1  1
          0.31290000          1.00000000
  1  0  0  1  1
          0.13142000          1.00000000
  1  0  0  1  1
          0.05470700          1.00000000
  1  0  0  1  1
          0.02103000          1.00000000
  1  1  1  5  1
        227.84000000          0.00112430
         53.92200000          0.00973930
         17.04800000          0.05453600
          6.00200000          0.23171000
          2.60660000          0.49931000
  1  1  1  1  1
          1.19620000          1.00000000
  1  1  1  1  1
          0.56967000          1.00000000
  1  1  1  1  1
          0.27377000          1.00000000
  1  1  1  1  1
          0.12880000          1.00000000
  1  1  1  1  1
          0.05965300          1.00000000
  1  1  1  1  1
          0.02619000          1.00000000
  1  1  1  1  1
          0.01057000          1.00000000
  1  2  2  1  1
          5.30000000          1.00000000
  1  2  2  1  1
          1.90000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          0.16000000          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  2  2  1  1
          0.03000000          1.00000000
  1  3  3  1  1
          1.90000000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.04228000          1.00000000
  1  4  4  1  1
          1.65000000          1.00000000
  1  4  4  1  1
          0.70000000          1.00000000
  1  4  4  1  1
          0.05285000          1.00000000
  1  5  5  1  1
          1.75000000          1.00000000
  1  5  5  1  1
          0.06341000          1.00000000
# CARBON
C  aug-pc-4
 32
  1  0  0 12  2
     527780.00000000          0.00000297          0.00000000
      79105.00000000          0.00002316          0.00000000
      18006.00000000          0.00012089          0.00000036
       5100.80000000          0.00051490         -0.00000359
       1664.70000000          0.00184580          0.00001809
        601.66000000          0.00602860          0.00000125
        235.40000000          0.01702300          0.00071075
         98.26300000          0.04407700          0.00253460
         43.26900000          0.08906100          0.01993400
         19.85800000          0.14817000          0.06504700
          9.56920000          0.06143600          0.27000000
          4.93730000          0.00000000          0.32854000
  1  0  0  1  1
          2.66870000          1.00000000
  1  0  0  1  1
          1.46740000          1.00000000
  1  0  0  1  1
          0.63863000          1.00000000
  1  0  0  1  1
          0.30240000          1.00000000
  1  0  0  1  1
          0.14116000          1.00000000
  1  0  0  1  1
          0.06374900          1.00000000
  1  0  0  1  1
          0.02645200          1.00000000
  1  1  1  5  1
        382.21000000          0.00098484
         90.48900000          0.00858470
         28.87100000          0.04827200
         10.38500000          0.20454000
          4.49720000          0.49867000
  1  1  1  1  1
          2.02740000          1.00000000
  1  1  1  1  1
          0.95154000          1.00000000
  1  1  1  1  1
          0.44815000          1.00000000
  1  1  1  1  1
          0.20721000          1.00000000
  1  1  1  1  1
          0.09487000          1.00000000
  1  1  1  1  1
          0.04084300          1.00000000
  1  1  1  1  1
          0.01620700          1.00000000
  1  2  2  1  1
          8.40000000          1.00000000
  1  2  2  1  1
          3.00000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  2  2  1  1
          0.04862200          1.00000000
  1  3  3  1  1
          2.10000000          1.00000000
  1  3  3  1  1
          0.90000000          1.00000000
  1  3  3  1  1
          0.40000000          1.00000000
  1  3  3  1  1
          0.06483000          1.00000000
  1  4  4  1  1
          2.10000000          1.00000000
  1  4  4  1  1
          0.90000000          1.00000000
  1  4  4  1  1
          0.08103700          1.00000000
  1  5  5  1  1
          1.85000000          1.00000000
  1  5  5  1  1
          0.09724400          1.00000000
# NITROGEN
N  aug-pc-4
 32
  1  0  0 12  2
     894760.00000000          0.00000226          0.00000000
     134830.00000000          0.00001754          0.00000000
      30808.00000000          0.00009117          0.00000000
       8751.50000000          0.00038740         -0.00000321
       2862.00000000          0.00138700          0.00001370
       1035.30000000          0.00455030         -0.00001486
        404.73000000          0.01300900          0.00048102
        168.33000000          0.03469600          0.00153840
         73.69500000          0.07480400          0.01355500
         33.75300000          0.13457000          0.04731100
         16.15700000          0.11672000          0.20160000
          7.96880000          0.00000000          0.40713000
  1  0  0  1  1
          3.95210000          1.00000000
  1  0  0  1  1
          1.94540000          1.00000000
  1  0  0  1  1
          0.92929000          1.00000000
  1  0  0  1  1
          0.44085000          1.00000000
  1  0  0  1  1
          0.20340000          1.00000000
  1  0  0  1  1
          0.09122600          1.00000000
  1  0  0  1  1
          0.03754200          1.00000000
  1  1  1  5  1
        566.23000000          0.00092433
        134.10000000          0.00808980
         43.01300000          0.04546300
         15.61200000          0.19622000
          6.64270000          0.51754000
  1  1  1  1  1
          2.97480000          1.00000000
  1  1  1  1  1
          1.38850000          1.00000000
  1  1  1  1  1
          0.65012000          1.00000000
  1  1  1  1  1
          0.30028000          1.00000000
  1  1  1  1  1
          0.13620000          1.00000000
  1  1  1  1  1
          0.05784500          1.00000000
  1  1  1  1  1
          0.02268400          1.00000000
  1  2  2  1  1
         12.80000000          1.00000000
  1  2  2  1  1
          4.40000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.37000000          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.06805300          1.00000000
  1  3  3  1  1
          2.30000000          1.00000000
  1  3  3  1  1
          1.00000000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.09073700          1.00000000
  1  4  4  1  1
          2.55000000          1.00000000
  1  4  4  1  1
          1.10000000          1.00000000
  1  4  4  1  1
          0.11342000          1.00000000
  1  5  5  1  1
          1.95000000          1.00000000
  1  5  5  1  1
          0.13611000          1.00000000
# OXYGEN
O  aug-pc-4
 32
  1  0  0 12  2
    1259700.00000000          0.00000207          0.00000000
     190110.00000000          0.00001596          0.00000000
      43449.00000000          0.00008333          0.00000000
      12342.00000000          0.00035212         -0.00000088
       4035.00000000          0.00127090          0.00000749
       1459.70000000          0.00413240          0.00001892
        570.66000000          0.01197000          0.00035166
        237.50000000          0.03156100          0.00170470
        104.11000000          0.06996000          0.01141200
         47.58100000          0.12702000          0.04602500
         22.54600000          0.11899000          0.19140000
         11.09300000          0.00000000          0.40260000
  1  0  0  1  1
          5.54090000          1.00000000
  1  0  0  1  1
          2.77940000          1.00000000
  1  0  0  1  1
          1.28370000          1.00000000
  1  0  0  1  1
          0.59649000          1.00000000
  1  0  0  1  1
          0.27057000          1.00000000
  1  0  0  1  1
          0.12028000          1.00000000
  1  0  0  1  1
          0.04909400          1.00000000
  1  1  1  5  1
        708.61000000          0.00104560
        167.86000000          0.00912920
         53.96700000          0.05097700
         19.80700000          0.21599000
          8.38320000          0.58777000
  1  1  1  1  1
          3.74470000          1.00000000
  1  1  1  1  1
          1.73220000          1.00000000
  1  1  1  1  1
          0.79977000          1.00000000
  1  1  1  1  1
          0.36323000          1.00000000
  1  1  1  1  1
          0.15963000          1.00000000
  1  1  1  1  1
          0.06566400          1.00000000
  1  1  1  1  1
          0.02496700          1.00000000
  1  2  2  1  1
         18.20000000          1.00000000
  1  2  2  1  1
          6.00000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
  1  2  2  1  1
          1.10000000          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.07490200          1.00000000
  1  3  3  1  1
          2.60000000          1.00000000
  1  3  3  1  1
          1.15000000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
  1  3  3  1  1
          0.09987000          1.00000000
  1  4  4  1  1
          3.05000000          1.00000000
  1  4  4  1  1
          1.30000000          1.00000000
  1  4  4  1  1
          0.12484000          1.00000000
  1  5  5  1  1
          2.05000000          1.00000000
  1  5  5  1  1
          0.14980000          1.00000000
# FLUORINE
F  aug-pc-4
 32
  1  0  0 12  2
    1856000.00000000          0.00000172          0.00000000
     280070.00000000          0.00001324          0.00000000
      64078.00000000          0.00006902          0.00000000
      18216.00000000          0.00029162         -0.00000081
       5957.80000000          0.00105220          0.00000585
       2155.00000000          0.00343010          0.00001118
        841.96000000          0.00997250          0.00026452
        349.82000000          0.02662500          0.00124470
        152.79000000          0.06039700          0.00880460
         69.36700000          0.11468000          0.03666600
         32.57400000          0.11487000          0.16212000
         15.88900000          0.00000000          0.37403000
  1  0  0  1  1
          7.86510000          1.00000000
  1  0  0  1  1
          3.91990000          1.00000000
  1  0  0  1  1
          1.78610000          1.00000000
  1  0  0  1  1
          0.82065000          1.00000000
  1  0  0  1  1
          0.36937000          1.00000000
  1  0  0  1  1
          0.16198000          1.00000000
  1  0  0  1  1
          0.06531300          1.00000000
  1  1  1  5  1
        917.89000000          0.00104500
        217.41000000          0.00914290
         69.93900000          0.05122700
         25.83100000          0.21558000
         10.96900000          0.59660000
  1  1  1  1  1
          4.92150000          1.00000000
  1  1  1  1  1
          2.28390000          1.00000000
  1  1  1  1  1
          1.05790000          1.00000000
  1  1  1  1  1
          0.48135000          1.00000000
  1  1  1  1  1
          0.20902000          1.00000000
  1  1  1  1  1
          0.08555600          1.00000000
  1  1  1  1  1
          0.03240800          1.00000000
  1  2  2  1  1
         25.50000000          1.00000000
  1  2  2  1  1
          8.00000000          1.00000000
  1  2  2  1  1
          3.20000000          1.00000000
  1  2  2  1  1
          1.45000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.09722300          1.00000000
  1  3  3  1  1
          3.10000000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.60000000          1.00000000
  1  3  3  1  1
          0.12963000          1.00000000
  1  4  4  1  1
          3.60000000          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  4  4  1  1
          0.16204000          1.00000000
  1  5  5  1  1
          2.15000000          1.00000000
  1  5  5  1  1
          0.19445000          1.00000000
# NEON
Ne aug-pc-4
 32
  1  0  0 12  2
    2522600.00000000          0.00000767          0.00000000
     377060.00000000          0.00005983          0.00000000
      85713.00000000          0.00031441          0.00000000
      24261.00000000          0.00133260         -0.00000020
       7911.70000000          0.00483320          0.00000212
       2855.50000000          0.01576300          0.00000758
       1113.60000000          0.04612300          0.00011055
        461.89000000          0.12339000          0.00058283
        201.35000000          0.28428000          0.00387530
         91.19800000          0.54569000          0.01708600
         42.68000000          0.58141000          0.07497800
         20.74200000          0.00000000          0.18391000
  1  0  0  1  1
         10.24900000          1.00000000
  1  0  0  1  1
          5.10130000          1.00000000
  1  0  0  1  1
          2.30310000          1.00000000
  1  0  0  1  1
          1.05310000          1.00000000
  1  0  0  1  1
          0.47222000          1.00000000
  1  0  0  1  1
          0.20466000          1.00000000
  1  0  0  1  1
          0.08164000          1.00000000
  1  1  1  5  1
       1169.90000000          0.00051064
        277.11000000          0.00447380
         89.26400000          0.02511000
         33.10000000          0.10593000
         14.03100000          0.29958000
  1  1  1  1  1
          6.29850000          1.00000000
  1  1  1  1  1
          2.92340000          1.00000000
  1  1  1  1  1
          1.35370000          1.00000000
  1  1  1  1  1
          0.61362000          1.00000000
  1  1  1  1  1
          0.26362000          1.00000000
  1  1  1  1  1
          0.10755000          1.00000000
  1  1  1  1  1
          0.04057000          1.00000000
  1  2  2  1  1
         32.00000000          1.00000000
  1  2  2  1  1
         10.10000000          1.00000000
  1  2  2  1  1
          4.00000000          1.00000000
  1  2  2  1  1
          1.85000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          0.12710000          1.00000000
  1  3  3  1  1
          3.60000000          1.00000000
  1  3  3  1  1
          1.55000000          1.00000000
  1  3  3  1  1
          0.70000000          1.00000000
  1  3  3  1  1
          0.16230000          1.00000000
  1  4  4  1  1
          4.20000000          1.00000000
  1  4  4  1  1
          1.80000000          1.00000000
  1  4  4  1  1
          0.20280000          1.00000000
  1  5  5  1  1
          2.25000000          1.00000000
  1  5  5  1  1
          0.24340000          1.00000000
# SODIUM
Na aug-pc-4
 21
  1  0  0 17  3
    1918700.00000000          0.00000274          0.00000000          0.00000000
     287270.00000000          0.00002133          0.00000000          0.00000000
      65382.00000000          0.00011221          0.00000000          0.00000000
      18523.00000000          0.00047369          0.00000000          0.00000000
       6045.40000000          0.00172350          0.00000000         -0.00000144
       2184.20000000          0.00559140         -0.00001790         -0.00001306
        853.11000000          0.01646100         -0.00006498         -0.00009742
        354.69000000          0.04377600         -0.00060909         -0.00063787
        155.33000000          0.10266000         -0.00260940         -0.00333940
         71.23400000          0.20074000         -0.01329500         -0.01514500
         33.83500000          0.30952000         -0.03986700         -0.04907900
         16.34900000          0.30826000         -0.09610800         -0.10865000
          8.00820000          0.14855000         -0.07047900         -0.08852700
          3.67130000          0.01711300          0.24565000          0.29366000
          1.71180000         -0.00155410          0.55362000          0.47915000
          0.79147000          0.00000000          0.45869000          0.15680000
          0.35479000          0.00000000          0.00000000         -0.57853000
  1  0  0  1  1
          0.09066400          1.00000000
  1  0  0  1  1
          0.04431300          1.00000000
  1  0  0  1  1
          0.02194800          1.00000000
  1  0  0  1  1
          0.01082100          1.00000000
  1  0  0  1  1
          0.00485700          1.00000000
  1  1  1 11  1
       3044.20000000          0.00002935
        720.02000000          0.00026100
        234.42000000          0.00148190
         89.66600000          0.00648150
         36.69500000          0.02480300
         16.25600000          0.06595400
          7.65930000          0.14794000
          3.71250000          0.24400000
          1.79920000          0.30244000
          0.86288000          0.27557000
          0.40104000          0.16219000
  1  1  1  1  1
          0.17759000          1.00000000
  1  1  1  1  1
          0.08070000          1.00000000
  1  1  1  1  1
          0.03670000          1.00000000
  1  1  1  1  1
          0.01670000          1.00000000
  1  1  1  1  1
          0.00697000          1.00000000
  1  2  2  1  1
          2.35000000          1.00000000
  1  2  2  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          0.14000000          1.00000000
  1  2  2  1  1
          0.01943000          1.00000000
  1  3  3  1  1
          1.08000000          1.00000000
  1  3  3  1  1
          0.24000000          1.00000000
  1  3  3  1  1
          0.02428000          1.00000000
  1  4  4  1  1
          0.30000000          1.00000000
  1  4  4  1  1
          0.02914000          1.00000000
# MAGNESIUM
Mg aug-pc-4
 21
  1  0  0 17  3
    3199100.00000000          0.00000090          0.00000000          0.00000000
     479000.00000000          0.00000701          0.00000000          0.00000000
     109010.00000000          0.00003689          0.00000000          0.00000000
      30878.00000000          0.00015584          0.00000000          0.00000000
      10075.00000000          0.00056784          0.00000000          0.00000000
       3637.90000000          0.00184930         -0.00000336          0.00000000
       1419.50000000          0.00548860         -0.00001119          0.00000139
        589.35000000          0.01487100         -0.00011126          0.00001097
        257.53000000          0.03631500         -0.00050000          0.00005638
        117.17000000          0.07751300         -0.00266410          0.00026010
         54.76200000          0.13593000         -0.00983480          0.00092696
         26.28800000          0.16490000         -0.02596400          0.00140020
         12.86000000          0.11240000         -0.03988900          0.00021032
          6.26040000          0.02650100          0.02928600         -0.00139360
          2.85140000          0.00006822          0.16700000          0.06338500
          1.30580000          0.00000000          0.15689000          0.35178000
          0.58331000          0.00000000          0.00000000          0.45980000
  1  0  0  1  1
          0.16849000          1.00000000
  1  0  0  1  1
          0.08564600          1.00000000
  1  0  0  1  1
          0.04507700          1.00000000
  1  0  0  1  1
          0.02193400          1.00000000
  1  0  0  1  1
          0.00972700          1.00000000
  1  1  1 11  1
       4157.80000000          0.00001234
        984.53000000          0.00010978
        320.09000000          0.00063086
        121.73000000          0.00283310
         49.89200000          0.01077300
         22.54200000          0.02877200
         10.74900000          0.06653700
          5.28990000          0.11557000
          2.59960000          0.15417000
          1.25180000          0.14665000
          0.59246000          0.08190400
  1  1  1  1  1
          0.26941000          1.00000000
  1  1  1  1  1
          0.12250000          1.00000000
  1  1  1  1  1
          0.05570000          1.00000000
  1  1  1  1  1
          0.02530000          1.00000000
  1  1  1  1  1
          0.01054000          1.00000000
  1  2  2  1  1
          3.36000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.03891000          1.00000000
  1  3  3  1  1
          1.35000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          0.04864000          1.00000000
  1  4  4  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          0.05836000          1.00000000
# ALUMINUM
Al aug-pc-4
 28
  1  0  0 17  3
    3845200.00000000          0.00000175          0.00000000          0.00000000
     575260.00000000          0.00001365          0.00000000          0.00000000
     130860.00000000          0.00007187          0.00000000          0.00000000
      37063.00000000          0.00030355          0.00000000          0.00000000
      12094.00000000          0.00110600          0.00000000         -0.00000109
       4366.80000000          0.00360350         -0.00001133         -0.00001050
       1703.60000000          0.01070200         -0.00006005         -0.00007868
        707.13000000          0.02903600         -0.00046344         -0.00052023
        308.97000000          0.07104500         -0.00237800         -0.00291520
        140.71000000          0.15195000         -0.01184200         -0.01384800
         65.91700000          0.26792000         -0.04567500         -0.05496800
         31.73000000          0.32914000         -0.11864000         -0.13850000
         15.58700000          0.22998000         -0.19088000         -0.22663000
          7.63820000          0.05743300          0.12421000          0.15454000
          3.54540000          0.00040260          0.72353000          0.75844000
          1.66790000          0.00000000          0.75665000          0.53134000
          0.76939000          0.00000000          0.00000000         -0.50362000
  1  0  0  1  1
          0.27917000          1.00000000
  1  0  0  1  1
          0.14016000          1.00000000
  1  0  0  1  1
          0.07033600          1.00000000
  1  0  0  1  1
          0.03366000          1.00000000
  1  0  0  1  1
          0.01470000          1.00000000
  1  1  1 12  2
       5687.30000000          0.00001998          0.00000000
       1345.20000000          0.00017728          0.00001010
        436.38000000          0.00103710          0.00000000
        165.45000000          0.00470060          0.00022858
         68.61900000          0.01742700         -0.00026528
         31.87500000          0.04664300          0.00155100
         15.43200000          0.11224000         -0.00904470
          7.75700000          0.20457000         -0.00361670
          3.92560000          0.29828000         -0.07048600
          1.97640000          0.30142000         -0.01171600
          0.99918000          0.18905000          0.04407300
          0.50630000          0.00000000          0.55310000
  1  1  1  1  1
          0.25847000          1.00000000
  1  1  1  1  1
          0.11566000          1.00000000
  1  1  1  1  1
          0.05104800          1.00000000
  1  1  1  1  1
          0.02120000          1.00000000
  1  1  1  1  1
          0.00812900          1.00000000
  1  2  2  1  1
         17.81000000          1.00000000
  1  2  2  1  1
          5.09000000          1.00000000
  1  2  2  1  1
          1.75000000          1.00000000
  1  2  2  1  1
          0.63000000          1.00000000
  1  2  2  1  1
          0.27000000          1.00000000
  1  2  2  1  1
          0.11000000          1.00000000
  1  2  2  1  1
          0.02439000          1.00000000
  1  3  3  1  1
          2.17000000          1.00000000
  1  3  3  1  1
          0.51000000          1.00000000
  1  3  3  1  1
          0.21000000          1.00000000
  1  3  3  1  1
          0.03252000          1.00000000
  1  4  4  1  1
          1.14000000          1.00000000
  1  4  4  1  1
          0.38000000          1.00000000
  1  4  4  1  1
          0.04064000          1.00000000
  1  5  5  1  1
          0.69000000          1.00000000
  1  5  5  1  1
          0.04877000          1.00000000
# SILICON
Si aug-pc-4
 28
  1  0  0 17  3
    4615800.00000000          0.00000166          0.00000000          0.00000000
     719010.00000000          0.00001213          0.00000000          0.00000000
     169990.00000000          0.00006097          0.00000000          0.00000000
      49400.00000000          0.00025124          0.00000000          0.00000000
      16385.00000000          0.00090088         -0.00000095          0.00000000
       5985.40000000          0.00290390         -0.00000194         -0.00000381
       2354.10000000          0.00858520         -0.00004218         -0.00002900
        981.40000000          0.02342100         -0.00020469         -0.00018868
        428.90000000          0.05842200         -0.00142610         -0.00109670
        194.54000000          0.12977000         -0.00637950         -0.00533750
         90.77700000          0.24037000         -0.02866400         -0.02274900
         43.71500000          0.32480000         -0.07569500         -0.06293600
         21.49100000          0.26684000         -0.15473000         -0.12525000
         10.66900000          0.09132400          0.01591300          0.00521670
          4.88820000          0.00534240          0.46344000          0.43080000
          2.33610000          0.00000000          0.60218000          0.71833000
          1.09670000          0.00000000          0.00000000          0.38360000
  1  0  0  1  1
          0.42312000          1.00000000
  1  0  0  1  1
          0.24276000          1.00000000
  1  0  0  1  1
          0.11703000          1.00000000
  1  0  0  1  1
          0.05286100          1.00000000
  1  0  0  1  1
          0.02189700          1.00000000
  1  1  1 12  2
       6453.30000000          0.00002165          0.00000000
       1533.90000000          0.00019162          0.00000096
        498.38000000          0.00111430         -0.00000017
        188.98000000          0.00508300          0.00001992
         77.88700000          0.01926900         -0.00003897
         35.51400000          0.05309100          0.00006333
         17.01600000          0.12639000         -0.00140570
          8.49770000          0.22312000         -0.00120800
          4.35440000          0.29854000         -0.01139000
          2.25750000          0.28651000          0.00460790
          1.15970000          0.17168000         -0.00057688
          0.59343000          0.00000000          0.13174000
  1  1  1  1  1
          0.29012000          1.00000000
  1  1  1  1  1
          0.13825000          1.00000000
  1  1  1  1  1
          0.06459400          1.00000000
  1  1  1  1  1
          0.02835400          1.00000000
  1  1  1  1  1
          0.01144200          1.00000000
  1  2  2  1  1
         19.52000000          1.00000000
  1  2  2  1  1
          5.58000000          1.00000000
  1  2  2  1  1
          1.92000000          1.00000000
  1  2  2  1  1
          0.69000000          1.00000000
  1  2  2  1  1
          0.29900000          1.00000000
  1  2  2  1  1
          0.12500000          1.00000000
  1  2  2  1  1
          0.03432600          1.00000000
  1  3  3  1  1
          2.64000000          1.00000000
  1  3  3  1  1
          0.62000000          1.00000000
  1  3  3  1  1
          0.26000000          1.00000000
  1  3  3  1  1
          0.04576800          1.00000000
  1  4  4  1  1
          1.35000000          1.00000000
  1  4  4  1  1
          0.45000000          1.00000000
  1  4  4  1  1
          0.05721100          1.00000000
  1  5  5  1  1
          0.78000000          1.00000000
  1  5  5  1  1
          0.06865300          1.00000000
# PHOSPHOROUS
P  aug-pc-4
 28
  1  0  0 17  3
    5262500.00000000          0.00000167          0.00000000          0.00000000
     822130.00000000          0.00001221          0.00000000          0.00000000
     194250.00000000          0.00006144          0.00000000          0.00000000
      56424.00000000          0.00025322          0.00000000          0.00000000
      18716.00000000          0.00090752         -0.00000088          0.00000000
       6839.30000000          0.00292300         -0.00000120         -0.00000486
       2693.10000000          0.00861380         -0.00003678         -0.00003786
       1126.50000000          0.02332900         -0.00016467         -0.00024017
        495.21000000          0.05764100         -0.00118610         -0.00138650
        226.38000000          0.12694000         -0.00509360         -0.00661190
        106.62000000          0.23408000         -0.02293900         -0.02784700
         51.90500000          0.31805000         -0.05950300         -0.07656600
         25.85100000          0.27002000         -0.12532000         -0.15527000
         13.02200000          0.10197000         -0.00340880         -0.01712400
          6.05680000          0.00808990          0.33461000          0.48842000
          2.95740000          0.00000000          0.50380000          0.90895000
          1.40780000          0.00000000          0.00000000          0.53649000
  1  0  0  1  1
          0.57187000          1.00000000
  1  0  0  1  1
          0.31078000          1.00000000
  1  0  0  1  1
          0.14947000          1.00000000
  1  0  0  1  1
          0.06831300          1.00000000
  1  0  0  1  1
          0.02860700          1.00000000
  1  1  1 12  2
       7748.60000000          0.00002087          0.00000000
       1833.60000000          0.00018596          0.00000082
        595.55000000          0.00107990         -0.00000028
        226.61000000          0.00489460          0.00001597
         94.19100000          0.01832000         -0.00004740
         43.33200000          0.05066900          0.00000117
         20.90700000          0.12156000         -0.00158320
         10.50200000          0.21931000         -0.00181170
          5.42550000          0.29640000         -0.01346500
          2.88180000          0.28179000          0.00615030
          1.52840000          0.17853000         -0.00714440
          0.81081000          0.00000000          0.14315000
  1  1  1  1  1
          0.39028000          1.00000000
  1  1  1  1  1
          0.18645000          1.00000000
  1  1  1  1  1
          0.08756700          1.00000000
  1  1  1  1  1
          0.03867300          1.00000000
  1  1  1  1  1
          0.01569300          1.00000000
  1  2  2  1  1
         21.23000000          1.00000000
  1  2  2  1  1
          6.07000000          1.00000000
  1  2  2  1  1
          2.09000000          1.00000000
  1  2  2  1  1
          0.75000000          1.00000000
  1  2  2  1  1
          0.32500000          1.00000000
  1  2  2  1  1
          0.13500000          1.00000000
  1  2  2  1  1
          0.04708000          1.00000000
  1  3  3  1  1
          3.12000000          1.00000000
  1  3  3  1  1
          0.73000000          1.00000000
  1  3  3  1  1
          0.30000000          1.00000000
  1  3  3  1  1
          0.06277400          1.00000000
  1  4  4  1  1
          1.55000000          1.00000000
  1  4  4  1  1
          0.52000000          1.00000000
  1  4  4  1  1
          0.07846700          1.00000000
  1  5  5  1  1
          0.87000000          1.00000000
  1  5  5  1  1
          0.09416100          1.00000000
# SULFUR
S  aug-pc-4
 28
  1  0  0 17  3
    6359200.00000000          0.00000156          0.00000000          0.00000000
     983890.00000000          0.00001156          0.00000000          0.00000000
     229770.00000000          0.00005902          0.00000000          0.00000000
      66276.00000000          0.00024474          0.00000000          0.00000000
      21884.00000000          0.00088159         -0.00000082          0.00000000
       7969.60000000          0.00284940         -0.00000103         -0.00000282
       3129.90000000          0.00842730         -0.00003412         -0.00002108
       1305.20000000          0.02295100         -0.00015187         -0.00013709
        571.70000000          0.05703800         -0.00110930         -0.00078935
        260.58000000          0.12616000         -0.00479670         -0.00382300
        122.48000000          0.23373000         -0.02168200         -0.01607200
         59.51800000          0.31883000         -0.05690800         -0.04492200
         29.62700000          0.27098000         -0.11915000         -0.09013700
         14.94300000          0.10217000         -0.00271680         -0.01063100
          7.04790000          0.00813260          0.30365000          0.27687000
          3.50400000          0.00000000          0.47588000          0.51960000
          1.69970000          0.00000000          0.00000000          0.30991000
  1  0  0  1  1
          0.73101000          1.00000000
  1  0  0  1  1
          0.37948000          1.00000000
  1  0  0  1  1
          0.18185000          1.00000000
  1  0  0  1  1
          0.08396100          1.00000000
  1  0  0  1  1
          0.03548700          1.00000000
  1  1  1 12  2
       9341.40000000          0.00001949          0.00000000
       2208.60000000          0.00017432          0.00000061
        716.27000000          0.00101610         -0.00000034
        272.51000000          0.00461720          0.00001063
        113.77000000          0.01716300         -0.00005018
         52.57100000          0.04813200         -0.00007805
         25.39700000          0.11704000         -0.00161880
         12.77000000          0.21602000         -0.00265510
          6.62240000          0.29528000         -0.01377700
          3.53880000          0.28825000          0.00242460
          1.87560000          0.17982000          0.00058572
          0.99018000          0.00000000          0.16518000
  1  1  1  1  1
          0.47723000          1.00000000
  1  1  1  1  1
          0.22692000          1.00000000
  1  1  1  1  1
          0.10473000          1.00000000
  1  1  1  1  1
          0.04530300          1.00000000
  1  1  1  1  1
          0.01803600          1.00000000
  1  2  2  1  1
         22.93000000          1.00000000
  1  2  2  1  1
          6.55000000          1.00000000
  1  2  2  1  1
          2.26000000          1.00000000
  1  2  2  1  1
          0.81000000          1.00000000
  1  2  2  1  1
          0.35100000          1.00000000
  1  2  2  1  1
          0.14600000          1.00000000
  1  2  2  1  1
          0.05410700          1.00000000
  1  3  3  1  1
          3.59000000          1.00000000
  1  3  3  1  1
          0.84000000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  3  3  1  1
          0.07214200          1.00000000
  1  4  4  1  1
          1.76000000          1.00000000
  1  4  4  1  1
          0.59000000          1.00000000
  1  4  4  1  1
          0.09017800          1.00000000
  1  5  5  1  1
          0.95000000          1.00000000
  1  5  5  1  1
          0.10821000          1.00000000
# CHLORINE
Cl aug-pc-4
 28
  1  0  0 17  3
    7421200.00000000          0.00000150          0.00000000          0.00000000
    1141100.00000000          0.00001124          0.00000000          0.00000000
     264430.00000000          0.00005800          0.00000000          0.00000000
      75791.00000000          0.00024215          0.00000000          0.00000000
      24925.00000000          0.00087550         -0.00000134          0.00000000
       9052.60000000          0.00283760         -0.00000184         -0.00000371
       3548.10000000          0.00840860         -0.00005817         -0.00002924
       1478.00000000          0.02290600         -0.00026634         -0.00018902
        647.35000000          0.05689500         -0.00191720         -0.00109400
        295.33000000          0.12569000         -0.00835970         -0.00529080
        138.98000000          0.23327000         -0.03750200         -0.02220500
         67.54900000          0.31894000         -0.09949500         -0.06245500
         33.66100000          0.27117000         -0.20640000         -0.12439000
         17.02700000          0.10247000         -0.00520630         -0.01497300
          8.15040000          0.00830670          0.50048000          0.36440000
          4.13190000          0.00000000          0.83332000          0.68717000
          2.04570000          0.00000000          0.00000000          0.39343000
  1  0  0  1  1
          0.94029000          1.00000000
  1  0  0  1  1
          0.46901000          1.00000000
  1  0  0  1  1
          0.22219000          1.00000000
  1  0  0  1  1
          0.10220000          1.00000000
  1  0  0  1  1
          0.04304600          1.00000000
  1  1  1 12  2
      11035.00000000          0.00001851          0.00000000
       2611.50000000          0.00016527          0.00000056
        848.02000000          0.00096233         -0.00000035
        323.00000000          0.00437770          0.00000920
        135.33000000          0.01621800         -0.00005112
         62.68400000          0.04610400         -0.00010597
         30.29800000          0.11348000         -0.00166890
         15.24000000          0.21353000         -0.00309980
          7.92590000          0.29438000         -0.01462800
          4.28530000          0.28778000          0.00123450
          2.30430000          0.18269000          0.00153150
          1.23570000          0.00000000          0.16993000
  1  1  1  1  1
          0.60021000          1.00000000
  1  1  1  1  1
          0.28739000          1.00000000
  1  1  1  1  1
          0.13185000          1.00000000
  1  1  1  1  1
          0.05697000          1.00000000
  1  1  1  1  1
          0.02265700          1.00000000
  1  2  2  1  1
         24.63000000          1.00000000
  1  2  2  1  1
          7.04000000          1.00000000
  1  2  2  1  1
          2.43000000          1.00000000
  1  2  2  1  1
          0.87000000          1.00000000
  1  2  2  1  1
          0.37700000          1.00000000
  1  2  2  1  1
          0.15700000          1.00000000
  1  2  2  1  1
          0.06797200          1.00000000
  1  3  3  1  1
          4.06000000          1.00000000
  1  3  3  1  1
          0.95000000          1.00000000
  1  3  3  1  1
          0.39000000          1.00000000
  1  3  3  1  1
          0.09062900          1.00000000
  1  4  4  1  1
          1.97000000          1.00000000
  1  4  4  1  1
          0.66000000          1.00000000
  1  4  4  1  1
          0.11329000          1.00000000
  1  5  5  1  1
          1.04000000          1.00000000
  1  5  5  1  1
          0.13594000          1.00000000
# ARGON
Ar aug-pc-4
 28
  1  0  0 17  3
    9445100.00000000          0.00000065          0.00000000          0.00000000
    1414100.00000000          0.00000503          0.00000000          0.00000000
     321810.00000000          0.00002648          0.00000000          0.00000000
      91158.00000000          0.00011190          0.00000000          0.00000000
      29743.00000000          0.00040791         -0.00000056          0.00000000
      10740.00000000          0.00133090         -0.00000040         -0.00000430
       4190.00000000          0.00396580         -0.00002366         -0.00003226
       1738.90000000          0.01086300         -0.00010267         -0.00021559
        759.29000000          0.02715900         -0.00077891         -0.00124380
        345.50000000          0.06051400         -0.00337400         -0.00612440
        162.36000000          0.11351000         -0.01548200         -0.02587800
         78.88800000          0.15827000         -0.04168700         -0.07483000
         39.32100000          0.13900000         -0.08942400         -0.15278000
         19.91800000          0.05564500         -0.01062200         -0.03707900
          9.57640000          0.00513770          0.20099000          0.43524000
          4.91610000          0.00000000          0.36722000          0.88582000
          2.46480000          0.00000000          0.00000000          0.60951000
  1  0  0  1  1
          1.18300000          1.00000000
  1  0  0  1  1
          0.57521000          1.00000000
  1  0  0  1  1
          0.27041000          1.00000000
  1  0  0  1  1
          0.12312000          1.00000000
  1  0  0  1  1
          0.05138000          1.00000000
  1  1  1 12  2
      13006.00000000          0.00000869          0.00000000
       3078.10000000          0.00007761          0.00000276
        999.56000000          0.00045249         -0.00000183
        380.97000000          0.00205950          0.00004540
        160.28000000          0.00758720         -0.00025551
         74.49400000          0.02182200         -0.00054968
         36.06500000          0.05433200         -0.00835420
         18.16400000          0.10442000         -0.01650400
          9.46650000          0.14645000         -0.07654200
          5.16300000          0.14426000          0.00166060
          2.80850000          0.09437900          0.00120150
          1.52350000          0.00000000          0.85169000
  1  1  1  1  1
          0.74379000          1.00000000
  1  1  1  1  1
          0.35680000          1.00000000
  1  1  1  1  1
          0.16221000          1.00000000
  1  1  1  1  1
          0.06995600          1.00000000
  1  1  1  1  1
          0.02777000          1.00000000
  1  2  2  1  1
         26.33000000          1.00000000
  1  2  2  1  1
          7.53000000          1.00000000
  1  2  2  1  1
          2.60000000          1.00000000
  1  2  2  1  1
          0.93000000          1.00000000
  1  2  2  1  1
          0.41000000          1.00000000
  1  2  2  1  1
          0.17000000          1.00000000
  1  2  2  1  1
          0.08331000          1.00000000
  1  3  3  1  1
          4.53000000          1.00000000
  1  3  3  1  1
          1.06000000          1.00000000
  1  3  3  1  1
          0.44000000          1.00000000
  1  3  3  1  1
          0.11110000          1.00000000
  1  4  4  1  1
          2.18000000          1.00000000
  1  4  4  1  1
          0.73000000          1.00000000
  1  4  4  1  1
          0.13890000          1.00000000
  1  5  5  1  1
          1.12000000          1.00000000
  1  5  5  1  1
          0.16660000          1.00000000
# BASIS="Ahlrichs VDZ"
#Elements                             References
#--------                             ----------
#H - Kr: A. Schafer, H. Horn and R. Ahlrichs, J. Chem. Phys. 97, 2571 (1992).
#
# HYDROGEN    (4s) -> [2s]
H  Ahlrichs-VDZ
  2
  1  0  0  3  1
         13.01070100          0.01968216
          1.96225720          0.13796524
          0.44453796          0.47831935
  1  0  0  1  1
          0.12194962          1.00000000
# HELIUM      (4s) -> [2s]
HE Ahlrichs-VDZ
  2
  1  0  0  3  1
         38.35493674          0.02381429
          5.76890815          0.15490907
          1.23994070          0.46998097
  1  0  0  1  1
          0.29757816          1.00000000
# LITHIUM     (7s) -> [3s]
LI Ahlrichs-VDZ
  3
  1  0  0  5  1
        266.27785516          0.00649202
         40.06978345          0.04774786
          9.05599444          0.20268796
          2.45030091          0.48606575
          0.72209572          0.43626978
  1  0  0  1  1
          0.05281088          1.00000000
  1  0  0  1  1
          0.02096095          1.00000000
# BERYLLIUM   (7s) -> [3s]
BE Ahlrichs-VDZ
  3
  1  0  0  5  1
        515.18616125          0.00556153
         77.51103760          0.04119007
         17.55248169          0.17913378
          4.80289406          0.44736716
          1.45162143          0.42009582
  1  0  0  1  1
          0.13281634          1.00000000
  1  0  0  1  1
          0.04583737          1.00000000
# BORON       (7s,4p) -> [3s,2p]
B  Ahlrichs-VDZ
  5
  1  0  0  5  1
        839.31830086         -0.00559292
        126.26464843         -0.04156552
         28.62060076         -0.18299817
          7.87937227         -0.46540392
          2.40888572         -0.44173885
  1  0  0  1  1
          0.25105109          1.00000000
  1  0  0  1  1
          0.08364887          1.00000000
  1  1  1  3  1
          6.03322236         -0.03560367
          1.24991579         -0.19895776
          0.33871676         -0.50850203
  1  1  1  1  1
          0.09641563          1.00000000
# CARBON      (7s,4p) -> [3s,2p]
C  Ahlrichs-VDZ
  5
  1  0  0  5  1
       1238.40169380          0.00545688
        186.29004992          0.04063841
         42.25117635          0.18025594
         11.67655793          0.46315122
          3.59305065          0.44087173
  1  0  0  1  1
          0.40245147          1.00000000
  1  0  0  1  1
          0.13090183          1.00000000
  1  1  1  3  1
          9.46809706          0.03838787
          2.01035451          0.21117025
          0.54771005          0.51328172
  1  1  1  1  1
          0.15268614          1.00000000
# NITROGEN    (7s,4p) -> [3s,2p]
N  Ahlrichs-VDZ
  5
  1  0  0  5  1
       1712.84158530         -0.00539341
        257.64812677         -0.04022158
         58.45824585         -0.17931145
         16.19836791         -0.46376318
          5.00526008         -0.44171423
  1  0  0  1  1
          0.58731857          1.00000000
  1  0  0  1  1
          0.18764592          1.00000000
  1  1  1  3  1
         13.57147023         -0.04007240
          2.92573729         -0.21807045
          0.79927751         -0.51294466
  1  1  1  1  1
          0.21954348          1.00000000
# OXYGEN      (7s,4p) -> [3s,2p]
O  Ahlrichs-VDZ
  5
  1  0  0  5  1
       2266.17677850         -0.00534318
        340.87010191         -0.03989004
         77.36313517         -0.17853912
         21.47964494         -0.46427685
          6.65894331         -0.44309745
  1  0  0  1  1
          0.80975976          1.00000000
  1  0  0  1  1
          0.25530772          1.00000000
  1  1  1  3  1
         17.72150432          0.04339457
          3.86355054          0.23094121
          1.04809209          0.51375311
  1  1  1  1  1
          0.27641544          1.00000000
# FLUORINE    (7s,4p) -> [3s,2p]
F  Ahlrichs-VDZ
  5
  1  0  0  5  1
       2894.83259900         -0.00534083
        435.41939120         -0.03990426
         98.84332887         -0.17912768
         27.48519800         -0.46758091
          8.54054982         -0.44653131
  1  0  0  1  1
          1.06545780          1.00000000
  1  0  0  1  1
          0.33247347          1.00000000
  1  1  1  3  1
         22.69663392         -0.04521287
          4.98723393         -0.23754317
          1.34916140         -0.51287354
  1  1  1  1  1
          0.34829882          1.00000000
# NEON        (7s,4p) -> [3s,2p]
NE Ahlrichs-VDZ
  5
  1  0  0  5  1
       3598.97366250         -0.00532593
        541.32073112         -0.03981742
        122.90450062         -0.17914358
         34.21661702         -0.46893583
         10.65058412         -0.44782538
  1  0  0  1  1
          1.35459540          1.00000000
  1  0  0  1  1
          0.41919363          1.00000000
  1  1  1  3  1
         28.42405379         -0.04603194
          6.28225110         -0.23993183
          1.69787151         -0.50871725
  1  1  1  1  1
          0.43300700          1.00000000
# SODIUM      (10s,5p) -> [4s,1p]
NA Ahlrichs-VDZ
  5
  1  0  0  5  1
       4098.20039080         -0.00585359
        616.49374031         -0.04364716
        139.96644001         -0.19431466
         39.07344105         -0.48685066
         11.92984721         -0.41881705
  1  0  0  3  1
         20.65996603          0.08594969
          1.98388610         -0.56359144
          0.64836324         -0.51954009
  1  0  0  1  1
          0.05244397          1.00000000
  1  0  0  1  1
          0.02804816          1.00000000
  1  1  1  5  1
         75.40186202          0.01543536
         17.27481898          0.09973829
          5.18423474          0.31209594
          1.66012120          0.49295675
          0.51232529          0.32420398
# MAGNESIUM   (10s,5p) -> [4s,1p]
MG Ahlrichs-VDZ
  5
  1  0  0  5  1
       4953.83391960         -0.00577790
        745.18044154         -0.04312476
        169.21604972         -0.19268217
         47.30067202         -0.48641439
         14.46133697         -0.42550894
  1  0  0  3  1
         24.76817479          0.08795697
          2.49409453         -0.55165058
          0.87807585         -0.53443295
  1  0  0  1  1
          0.08721278          1.00000000
  1  0  0  1  1
          0.03359929          1.00000000
  1  1  1  5  1
         98.05301049         -0.01448056
         22.58693228         -0.09549575
          6.83915098         -0.30787673
          2.23328438         -0.49936293
          0.71606599         -0.31503476
# ALUMINUM    (10s,7p) -> [4s,3p]
AL Ahlrichs-VDZ
  7
  1  0  0  5  1
       5887.57270300          0.00134833
        885.61225996          0.01007158
        201.13604899          0.04513245
         56.28497467          0.11461268
         17.22955124          0.10159609
  1  0  0  3  1
         29.34024992          0.06934745
          3.04396304         -0.42528118
          1.12855395         -0.41449832
  1  0  0  1  1
          0.14234175          1.00000000
  1  0  0  1  1
          0.05440019          1.00000000
  1  1  1  5  1
        145.11918809          0.00639634
         33.71789483          0.04418936
         10.36986308          0.15581576
          3.51356160          0.28635287
          1.19800503          0.22921423
  1  1  1  1  1
          0.26583006          1.00000000
  1  1  1  1  1
          0.07100336          1.00000000
# SILICON     (10s,7p) -> [4s,3p]
SI Ahlrichs-VDZ
  7
  1  0  0  5  1
       6903.71186860          0.00133740
       1038.43464190          0.00999665
        235.87581480          0.04491017
         66.06938517          0.11463639
         20.24794576          0.10280064
  1  0  0  3  1
         34.35348173          0.07083729
          3.63707882         -0.43028836
          1.40020486         -0.41382775
  1  0  0  1  1
          0.20484415          1.00000000
  1  0  0  1  1
          0.07799410          1.00000000
  1  1  1  5  1
        179.83907373          0.00619167
         41.90725885          0.04339943
         12.95529437          0.15632019
          4.43832674          0.29419997
          1.54622479          0.23536824
  1  1  1  1  1
          0.35607612          1.00000000
  1  1  1  1  1
          0.10008514          1.00000000
# PHOSPHORUS  (10s,7p) -> [4s,3p]
P  Ahlrichs-VDZ
  7
  1  0  0  5  1
       8002.47951060          0.00575035
       1203.68135900          0.04300763
        273.44227031          0.19363986
         76.65554152          0.49651693
         23.51692744          0.44983262
  1  0  0  3  1
         39.79168344          0.09518813
          4.27703433         -0.57649840
          1.69402569         -0.54239584
  1  0  0  1  1
          0.27567675          1.00000000
  1  0  0  1  1
          0.10495590          1.00000000
  1  1  1  5  1
        219.50755823          0.00921006
         51.27415503          0.06540977
         15.92159589          0.24033730
          5.50699135          0.46318322
          1.95377194          0.37392563
  1  1  1  1  1
          0.47803398          1.00000000
  1  1  1  1  1
          0.13657953          1.00000000
# SULFUR      (10s,7p) -> [4s,3p]
S  Ahlrichs-VDZ
  7
  1  0  0  5  1
       9184.93030100         -0.00222944
       1381.51055030         -0.01668303
        313.87147580         -0.07526244
         88.05387062         -0.19376827
         27.03991491         -0.17718021
  1  0  0  3  1
         45.64873130         -0.10736063
          4.96645223          0.65066293
          2.01162420          0.59712155
  1  0  0  1  1
          0.35661077          1.00000000
  1  0  0  1  1
          0.13507221          1.00000000
  1  1  1  5  1
        261.98233439         -0.00927299
         61.30689474         -0.06654767
         19.10372989         -0.24828596
          6.65677204         -0.48703847
          2.39596352         -0.39337850
  1  1  1  1  1
          0.61776162          1.00000000
  1  1  1  1  1
          0.16993377          1.00000000
# CHLORINE    (10s,7p) -> [4s,3p]
CL Ahlrichs-VDZ
  7
  1  0  0  5  1
      10449.82756600          0.00197084
       1571.73652210          0.01475473
        357.12065523          0.06667911
        100.25185935          0.17228924
         30.81272755          0.15883786
  1  0  0  3  1
         51.92378943         -0.10009299
          5.70457610          0.60841753
          2.35083768          0.54352153
  1  0  0  1  1
          0.44605125          1.00000000
  1  0  0  1  1
          0.16848856          1.00000000
  1  1  1  5  1
        307.66790569         -0.00878015
         72.10201551         -0.06356336
         22.53268026         -0.24016428
          7.89917654         -0.47798867
          2.87672683         -0.38515850
  1  1  1  1  1
          0.77459364          1.00000000
  1  1  1  1  1
          0.21037700          1.00000000
# ARGON       (10s,7p) -> [4s,3p]
AR Ahlrichs-VDZ
  7
  1  0  0  5  1
      11797.11976500          0.00202145
       1774.35227530          0.01513985
        403.18875733          0.06852540
        113.24933999          0.17762929
         34.83529819          0.16496495
  1  0  0  3  1
         58.61477504         -0.10343394
          6.49220451          0.63133366
          2.71170144          0.54887572
  1  0  0  1  1
          0.54412975          1.00000000
  1  0  0  1  1
          0.20517411          1.00000000
  1  1  1  5  1
        356.28707256         -0.00873218
         83.59313287         -0.06368032
         26.18670403         -0.24311907
          9.22572759         -0.48956070
          3.39227550         -0.39229190
  1  1  1  1  1
          0.94740534          1.00000000
  1  1  1  1  1
          0.25659135          1.00000000
# POTASSIUM   (14s,8p) -> [5s,2p]
K  Ahlrichs-VDZ
  7
  1  0  0  6  1
      31478.74676400          0.00398387
       4726.88760660          0.03050176
       1075.43453530          0.15073753
        303.39811023          0.51912940
         98.32711283          1.03669570
         33.63622218          0.76398963
  1  0  0  3  1
         65.63920996         -0.28242617
          7.31625922          1.69149359
          2.89025801          1.29653320
  1  0  0  3  1
          4.54597490         -0.00763436
          0.70404124          0.02563572
          0.28266889          0.01660686
  1  0  0  1  1
          0.02905816          1.00000000
  1  0  0  1  1
          0.01211164          1.00000000
  1  1  1  5  1
        361.22492154          0.02090648
         84.67022217          0.15043642
         26.46908824          0.55440061
          9.26580776          1.04090100
          3.34233883          0.67825341
  1  1  1  3  1
          1.51008761          0.75248191
          0.56568375          1.37085850
          0.20817008          0.66047633
# CALCIUM     (14s,8p) -> [5s,2p]
CA Ahlrichs-VDZ
  7
  1  0  0  6  1
      35138.71392900          0.00394825
       5276.41113480          0.03023424
       1200.46925890          0.14952020
        338.71810542          0.51597346
        109.85385922          1.03395103
         37.60888030          0.76937934
  1  0  0  3  1
         73.10797755         -0.28268525
          8.24077057          1.67960921
          3.29598130          1.28037660
  1  0  0  3  1
          5.23418009         -0.00768686
          0.84187221          0.02538238
          0.36510294          0.01651217
  1  0  0  1  1
          0.05122240          1.00000000
  1  0  0  1  1
          0.01982511          1.00000000
  1  1  1  5  1
        413.11313893          0.02032714
         96.93578622          0.14730276
         30.37215466          0.54887167
         10.68477683          1.04406598
          3.88212583          0.68653491
  1  1  1  3  1
          1.79930163          0.75410247
          0.69189057          1.34092966
          0.26364024          0.56391989
# SCANDIUM    (14s,8p,5d) -> [5s,2p,2d]
SC Ahlrichs-VDZ
  9
  1  0  0  6  1
      38956.08180400          0.00392932
       5849.57336370          0.03009322
       1330.88131540          0.14890371
        375.55534165          0.51464283
        121.87261370          1.03377081
         41.76024373          0.77436852
  1  0  0  3  1
         81.06063395         -0.28318552
          9.20598240          1.67708070
          3.70632157          1.25947337
  1  0  0  3  1
          5.98889100         -0.00778214
          0.97363432          0.02549969
          0.42041019          0.01619156
  1  0  0  1  1
          0.05944055          1.00000000
  1  0  0  1  1
          0.02289781          1.00000000
  1  1  1  5  1
        466.31481262          0.01998430
        109.51217097          0.14561043
         34.37592183          0.54687466
         12.14209696          1.04790060
          4.43367677          0.68894890
  1  1  1  3  1
          2.09712919          0.75619215
          0.80977607          1.31782122
          0.30834047          0.54312268
  1  2  2  4  1
         19.24033493          0.02703908
          5.11789959          0.13803685
          1.65542788          0.34869086
          0.54016356          0.48594186
  1  2  2  1  1
          0.16211215          1.00000000
# TITANIUM    (14s,8p,5d) -> [5s,2p,2d]
TI Ahlrichs-VDZ
  9
  1  0  0  6  1
      42961.51218500          0.00391276
       6450.97591690          0.02996982
       1467.72109150          0.14836353
        414.20997355          0.51347285
        134.48715840          1.03353655
         46.12220980          0.77854234
  1  0  0  3  1
         89.44776254         -0.28385401
         10.22334606          1.67727853
          4.13537743          1.24119285
  1  0  0  3  1
          6.78961815         -0.00784000
          1.11067307          0.02549549
          0.47565976          0.01606117
  1  0  0  1  1
          0.06598696          1.00000000
  1  0  0  1  1
          0.02521034          1.00000000
  1  1  1  5  1
        522.03684782          0.01975418
        122.68649489          0.14460678
         38.57290361          0.54669004
         13.67216932          1.05316475
          5.01185294          0.69111213
  1  1  1  3  1
          2.41319283          0.75803437
          0.93252270          1.30362414
          0.35429058          0.53638653
  1  2  2  4  1
         23.46512596          0.02653638
          6.33325938          0.13796454
          2.07664899          0.35312644
          0.69027362          0.48647124
  1  2  2  1  1
          0.21088739          0.33026314
# VANADIUM    (14s,8p,5d) -> [5s,2p,2d]
V  Ahlrichs-VDZ
  9
  1  0  0  6  1
      47160.37606000          0.00144987
       7081.41108710          0.01110644
       1611.16212230          0.05500542
        454.72940551          0.19060253
        147.71321208          0.38435023
         50.69953895          0.29095547
  1  0  0  3  1
         98.26249267         -0.10942338
         11.29429310          0.64539490
          4.58533601          0.47117881
  1  0  0  3  1
          7.63596896         -0.22454949
          1.25398367          0.72594853
          0.53271935          0.45560583
  1  0  0  1  1
          0.07224624          1.00000000
  1  0  0  1  1
          0.02735809          1.00000000
  1  1  1  5  1
        580.55044988          0.00973151
        136.52341127          0.07153124
         42.98395882          0.27197688
         15.28279876          0.52618989
          5.62024952          0.34452533
  1  1  1  3  1
          2.74853864          0.34040396
          1.06185501          0.57983996
          0.40235519          0.23911643
  1  2  2  4  1
         27.35843402          0.02664193
          7.45406043          0.13995312
          2.46339178          0.35751067
          0.82480925          0.48488354
  1  2  2  1  1
          0.25257905          0.32332845
# CHROMIUM    (14s,8p,5d) -> [5s,2p,2d]
CR Ahlrichs-VDZ
  9
  1  0  0  6  1
      51528.08634900          0.00144058
       7737.21034870          0.01103620
       1760.37484700          0.05467665
        496.87706544          0.18965038
        161.46520598          0.38295413
         55.46635227          0.29090051
  1  0  0  3  1
        107.54732999         -0.10932281
         12.40867190          0.64472599
          5.04236288          0.46262713
  1  0  0  3  1
          8.54616402         -0.22711013
          1.39004412          0.73301528
          0.56066603          0.44225565
  1  0  0  1  1
          0.07148371          1.00000000
  1  0  0  1  1
          0.02825069          1.00000000
  1  1  1  5  1
        640.48536096          0.00961267
        150.69711194          0.07088983
         47.50375530          0.27065259
         16.93412017          0.52437343
          6.24096806          0.34107995
  1  1  1  3  1
          3.08854632          0.33973987
          1.17910478          0.57272063
          0.43369774          0.24582728
  1  2  2  4  1
         27.55947943          0.03061249
          7.46870203          0.15593271
          2.43459036          0.36984421
          0.78244755          0.47071118
  1  2  2  1  1
          0.21995774          0.33941650
# MANGANESE   (14s,8p,5d) -> [5s,2p,2d]
MN Ahlrichs-VDZ
  9
  1  0  0  6  1
      56137.00903700          0.00143213
       8429.20639430          0.01097251
       1917.82772330          0.05438247
        541.36230198          0.18884335
        176.00069142          0.38198025
         60.50047701          0.29156773
  1  0  0  3  1
        117.17282882         -0.10933661
         13.59697337          0.64305039
          5.54839963          0.45848971
  1  0  0  3  1
          9.46628535         -0.22538977
          1.55950061          0.72307759
          0.65230206          0.45300722
  1  0  0  1  1
          0.08400373          1.00000000
  1  0  0  1  1
          0.03125610          1.00000000
  1  1  1  5  1
        706.00497535          0.00950555
        166.19728820          0.07035627
         52.45206191          0.27005557
         18.74693286          0.52574345
          6.92829916          0.34254033
  1  1  1  3  1
          3.47722049          0.33994074
          1.34069064          0.57203836
          0.50498803          0.23847606
  1  2  2  4  1
         35.42326493          0.02698530
          9.78142215          0.14383459
          3.26734888          0.36418958
          1.10264722          0.48152671
  1  2  2  1  1
          0.33743206          0.31458754
# IRON        (14s,8p,5d) -> [5s,2p,2d]
FE Ahlrichs-VDZ
  9
  1  0  0  6  1
      60923.64064300          0.00143023
       9147.88939820          0.01095879
       2081.35059270          0.05433255
        587.55977067          0.18884995
        191.09043990          0.38253070
         65.73273011          0.29308336
  1  0  0  3  1
        127.25891928         -0.10964565
         14.83091301          0.64387631
          6.06533074          0.45472347
  1  0  0  3  1
         10.44994371         -0.22539640
          1.72452280          0.72164398
          0.71772177          0.44985493
  1  0  0  1  1
          0.09144983          1.00000000
  1  0  0  1  1
          0.03370669          1.00000000
  1  1  1  5  1
        773.43750995          0.00943257
        182.15149714          0.07002962
         57.54727276          0.26993652
         20.61498894          0.52700011
          7.63485579          0.34284148
  1  1  1  3  1
          3.87193280          0.33974403
          1.49247241          0.56842594
          0.56061285          0.23649366
  1  2  2  4  1
         38.96813342          0.02787966
         10.80006708          0.14858320
          3.61364580          0.36905479
          1.21299679          0.47745101
  1  2  2  1  1
          0.36524393          0.31418142
# COBALT      (14s,8p,5d) -> [5s,2p,2d]
CO Ahlrichs-VDZ
  9
  1  0  0  6  1
      65902.20825700          0.00142846
       9895.38960270          0.01094607
       2251.43057890          0.05428595
        635.61097084          0.18885179
        206.78820681          0.38301635
         71.17924297          0.29443551
  1  0  0  3  1
        137.77268040         -0.10990222
         16.11807924          0.64455537
          6.60303277          0.45116788
  1  0  0  3  1
         11.47991579         -0.22593847
          1.89564263          0.72231409
          0.78466232          0.44903812
  1  0  0  1  1
          0.09842577          1.00000000
  1  0  0  1  1
          0.03594574          1.00000000
  1  1  1  5  1
        843.64358575          0.00938661
        198.76386994          0.06988021
         62.85496310          0.27037070
         22.56284228          0.52904787
          8.37132091          0.34357030
  1  1  1  3  1
          4.28587198          0.34027999
          1.65080418          0.56693392
          0.61834231          0.23617980
  1  2  2  4  1
         42.92786761          0.02848779
         11.94253305          0.15206951
          4.00464957          0.37310914
          1.34131938          0.47549838
  1  2  2  1  1
          0.40015010          0.31346831
# NICKEL      (14s,8p,5d) -> [5s,2p,2d]
NI Ahlrichs-VDZ
  9
  1  0  0  6  1
      71074.80321100          0.00142604
      10672.02094100          0.01092824
       2428.13890070          0.05421263
        685.53595148          0.18874769
        223.10072863          0.38324617
         76.84201404          0.29550637
  1  0  0  3  1
        148.71122016         -0.11014443
         17.45915499          0.64521427
          7.16252807          0.44797838
  1  0  0  3  1
         12.55613713         -0.22645403
          2.07357405          0.72320959
          0.85382641          0.44868026
  1  0  0  1  1
          0.10536766          1.00000000
  1  0  0  1  1
          0.03813409          1.00000000
  1  1  1  5  1
        916.73608662          0.00934396
        216.06139913          0.06973737
         68.38391482          0.27073495
         24.59384395          0.53078302
          9.13929602          0.34410229
  1  1  1  3  1
          4.71933717          0.34076082
          1.81618492          0.56580170
          0.67840751          0.23616717
  1  2  2  4  1
         47.09383211          0.02898232
         13.14646397          0.15494996
          4.41705489          0.37633115
          1.47715651          0.47365096
  1  2  2  1  1
          0.43735922          0.31247838
# COPPER      (14s,8p,5d) -> [5s,2p,2d]
CU Ahlrichs-VDZ
  9
  1  0  0  6  1
      76381.34805600          0.00143361
      11468.77749900          0.01098675
       2609.42464950          0.05451365
        736.75033098          0.18990128
        239.82419958          0.38581959
         82.65682925          0.29790607
  1  0  0  3  1
        160.13544196         -0.11146779
         18.83417770          0.65349301
          7.71765957          0.44770534
  1  0  0  3  1
         13.71084672         -0.22870911
          2.23498957          0.73464423
          0.87818360          0.43273071
  1  0  0  1  1
          0.08718746          1.00000000
  1  0  0  1  1
          0.03296911          1.00000000
  1  1  1  5  1
        991.24075782          0.00938785
        233.69376116          0.07020828
         74.02093093          0.27323522
         26.66496745          0.53580793
          9.91920875          0.34575795
  1  1  1  3  1
          5.15195539          0.34229108
          1.96382058          0.56456592
          0.71560097          0.24078584
  1  2  2  4  1
         47.33504959          0.03237555
         13.16166608          0.16810219
          4.36937772          0.38477708
          1.41329251          0.46147880
  1  2  2  1  1
          0.38878001          0.32388873
# ZINC        (13s,8p,5d) -> [5s,2p,2d]
ZN Ahlrichs-VDZ
  9
  1  0  0  6  1
      82000.71162900          0.00142108
      12312.47177700          0.01089150
       2801.39441930          0.05405719
        790.99424302          0.18847464
        257.56551079          0.38346549
         88.81493340          0.29723794
  1  0  0  3  1
        171.86353716         -0.11051850
         20.30253478          0.64607717
          8.34641231          0.44220117
  1  0  0  3  1
         14.84753694         -0.22705309
          2.44950295          0.72433218
          0.99845822          0.44836496
  1  0  0  1  1
          0.11891308          1.00000000
  1  0  0  1  1
          0.04229743          1.00000000
  1  1  1  5  1
       1071.51853720          0.00927678
        252.69712152          0.06954115
         80.10082913          0.27156773
         28.90339317          0.53401356
         10.76889988          0.34501323
  1  1  1  3  1
          5.64462125          0.34129600
          2.16782913          0.56390522
          0.80540898          0.23676110
  1  2  2  4  1
         56.08893919          0.02958887
         15.75190892          0.15872571
          5.31158124          0.37976229
          1.77379049          0.46898959
  1  2  2  1  1
          0.51975584          0.30907149
# GALLIUM     (14s,10p,5d) -> [5s,4p,2d]
GA Ahlrichs-VDZ
 11
  1  0  0  6  1
      87842.12629600          0.00142716
      13189.49640200          0.01093889
       3000.94821410          0.05430820
        847.38425966          0.18951056
        276.00980642          0.38615186
         95.21667207          0.30051083
  1  0  0  3  1
        184.00703968         -0.11124462
         21.82705143          0.64831323
          9.00269638          0.44358384
  1  0  0  3  1
         16.03317694         -0.23014300
          2.67077249          0.72946862
          1.12528342          0.46214977
  1  0  0  1  1
          0.15967609          1.00000000
  1  0  0  1  1
          0.05764304          1.00000000
  1  1  1  5  1
       1167.26658440          0.00909740
        275.38062789          0.06845627
         87.37507307          0.26922294
         31.59725467          0.53507898
         11.82412280          0.35279063
  1  1  1  3  1
          6.28818451          0.33938245
          2.51998532          0.56871948
          1.01697263          0.27717695
  1  1  1  1  1
          0.24748374          1.00000000
  1  1  1  1  1
          0.06668529          1.00000000
  1  2  2  4  1
         65.35423767          0.02737015
         18.50465675          0.15099464
          6.31796206          0.37485329
          2.16413894          0.47510607
  1  2  2  1  1
          0.66693093          0.29843287
# GERMANIUM   (14s,10p,5d) -> [5s,4p,2d]
GE Ahlrichs-VDZ
 11
  1  0  0  6  1
      93889.83664200          0.00142340
      14097.49752800          0.01091080
       3207.54773090          0.05418371
        905.76727269          0.18922820
        295.11014693          0.38612847
        101.84713141          0.30164051
  1  0  0  3  1
        196.56719662         -0.11118771
         23.40529252          0.64616007
          9.68391167          0.44188905
  1  0  0  3  1
         17.26973654         -0.23027421
          2.89646222          0.73017169
          1.25536214          0.46197222
  1  0  0  1  1
          0.20213081          1.00000000
  1  0  0  1  1
          0.07386791          1.00000000
  1  1  1  5  1
       1259.20859950          0.00901155
        297.15626382          0.06798684
         94.35338752          0.26853856
         34.17632968          0.53659649
         12.81613962          0.35633515
  1  1  1  3  1
          6.84710298          0.33900693
          2.77173639          0.56809365
          1.14584182          0.27246540
  1  1  1  1  1
          0.30679632          1.00000000
  1  1  1  1  1
          0.08928364          1.00000000
  1  2  2  4  1
         74.78216818          0.02575586
         21.31084976          0.14536816
          7.34647924          0.37134210
          2.56562714          0.48002998
  1  2  2  1  1
          0.81981773          0.28978791
# ARSENIC     (14s,10p,5d) -> [5s,4p,2d]
AS Ahlrichs-VDZ
 11
  1  0  0  6  1
     100146.52554000          0.00142583
      15036.86171100          0.01093018
       3421.29028330          0.05429417
        966.16965717          0.18976078
        314.87394026          0.38775195
        108.70823790          0.30402812
  1  0  0  3  1
        209.54238950         -0.11162094
         25.03822114          0.64697608
         10.39096434          0.44223609
  1  0  0  3  1
         18.55509009         -0.22994191
          3.12812174          0.73319108
          1.38848851          0.45533654
  1  0  0  1  1
          0.24714362          1.00000000
  1  0  0  1  1
          0.09142943          1.00000000
  1  1  1  5  1
       1355.64435070          0.00891825
        319.99929270          0.06745475
        101.67734092          0.26759772
         36.88632384          0.53776845
         13.86111591          0.35992570
  1  1  1  3  1
          7.42606669          0.34036850
          3.03162472          0.57030149
          1.27830783          0.26606170
  1  1  1  1  1
          0.37568503          1.00000000
  1  1  1  1  1
          0.11394805          1.00000000
  1  2  2  4  1
         84.44551454          0.02451840
         24.19041610          0.14107455
          8.40450151          0.36875229
          2.98089707          0.48409561
  1  2  2  1  1
          0.97909243          0.28250269
# SELENIUM    (14s,10p,5d) -> [5s,4p,2d]
SE Ahlrichs-VDZ
 11
  1  0  0  6  1
     106612.20027000          0.00142749
      16007.60470100          0.01094353
       3642.16997070          0.05437417
       1028.59129930          0.19018093
        335.30298888          0.38913022
        115.80129154          0.30620207
  1  0  0  3  1
        222.93325020         -0.11198808
         26.72625793          0.64752124
         11.12450192          0.44241977
  1  0  0  3  1
         19.88852006         -0.22857228
          3.36684738          0.73591360
          1.52492778          0.44330200
  1  0  0  1  1
          0.29630038          1.00000000
  1  0  0  1  1
          0.11009289          1.00000000
  1  1  1  5  1
       1455.90681200          0.00882036
        343.75101831          0.06687585
        109.29554964          0.26640578
         39.70771102          0.53834928
         14.95018523          0.36303282
  1  1  1  3  1
          8.02089621          0.34153807
          3.29346498          0.57257907
          1.40586024          0.25549813
  1  1  1  1  1
          0.45076123          1.00000000
  1  1  1  1  1
          0.13353413          1.00000000
  1  2  2  4  1
         94.49402404          0.02349010
         27.18818526          0.13747736
          9.50915674          0.36649929
          3.41705169          0.48750990
  1  2  2  1  1
          1.14795901          0.27657943
# BROMINE     (14s,10p,5d) -> [5s,4p,2d]
BR Ahlrichs-VDZ
 11
  1  0  0  6  1
     113286.38776000          0.00142830
      17009.62630300          0.01095042
       3870.18425670          0.05442101
       1093.03572270          0.19047908
        356.39721797          0.39024643
        123.12539643          0.30814433
  1  0  0  3  1
        236.74084007         -0.11228066
         28.46866107          0.64775962
         11.88344372          0.44235576
  1  0  0  3  1
         21.26963331         -0.22642576
          3.61292268          0.73823712
          1.66266490          0.42683869
  1  0  0  1  1
          0.34823793          1.00000000
  1  0  0  1  1
          0.13019031          1.00000000
  1  1  1  5  1
       1560.28018810          0.00871667
        368.47859205          0.06624364
        117.22978849          0.26495610
         42.64890925          0.53839161
         16.08722510          0.36579388
  1  1  1  3  1
          8.63528101          0.34248787
          3.56136655          0.57500678
          1.52926266          0.24330394
  1  1  1  1  1
          0.53064295          1.00000000
  1  1  1  1  1
          0.15702759          1.00000000
  1  2  2  4  1
        104.85518642          0.02265015
         30.28114369          0.13455483
         10.65139427          0.36474455
          3.86994562          0.49044587
  1  2  2  1  1
          1.32408768          0.27137289
# KRYPTON     (14s,10p,5d) -> [5s,4p,2d]
KR Ahlrichs-VDZ
 11
  1  0  0  6  1
     120165.64875000          0.00142942
      18042.50016900          0.01095960
       4105.18003880          0.05447965
       1159.44472480          0.19081239
        378.13810346          0.39140446
        130.67610045          0.31007347
  1  0  0  3  1
        250.96373353         -0.11258604
         30.26593038          0.64816323
         12.66811076          0.44240239
  1  0  0  3  1
         22.69794010         -0.22391965
          3.86730174          0.74060953
          1.80137067          0.40803658
  1  0  0  1  1
          0.40308639          1.00000000
  1  0  0  1  1
          0.15170528          1.00000000
  1  1  1  5  1
       1668.57366230          0.00862150
        394.13862798          0.06566551
        125.46644854          0.26366577
         45.70499273          0.53867659
         17.27013323          0.36865168
  1  1  1  3  1
          9.26994878          0.34346189
          3.83646177          0.57784776
          1.64671633          0.23075615
  1  1  1  1  1
          0.61479686          1.00000000
  1  1  1  1  1
          0.18319467          1.00000000
  1  2  2  4  1
        115.55868603          0.02194549
         33.47798586          0.13211213
         11.83445021          0.36333307
          4.34082549          0.49300484
  1  2  2  1  1
          1.50792732          0.26676859
# BASIS="Ahlrichs VTZ"
#Elements                             References
#--------                             ----------
#H - Kr: A. Schafer, H. Horn and R. Ahlrichs, J. Chem. Phys. 97, 2571 (1992).
#
# HYDROGEN    (5s) -> [3s]
H  Ahlrichs-VTZ
  3
  1  0  0  3  1
         34.06134100          0.00602520
          5.12357460          0.04502109
          1.16466260          0.20189726
  1  0  0  1  1
          0.32723041          1.00000000
  1  0  0  1  1
          0.10307241          1.00000000
# HELIUM      (5s) -> [3s]
HE Ahlrichs-VTZ
  3
  1  0  0  3  1
         98.07832162          0.00758031
         14.76440425          0.05484862
          3.31858315          0.22074382
  1  0  0  1  1
          0.87413870          1.00000000
  1  0  0  1  1
          0.24459897          1.00000000
# LITHIUM     (10s) -> [6s]
LI Ahlrichs-VTZ
  6
  1  0  0  5  1
       3341.40288120          0.00068826
        500.95159311          0.00532964
        114.01103106          0.02756437
         32.26547306          0.10988243
         10.47205852          0.33943049
  1  0  0  1  1
          3.69782842          1.00000000
  1  0  0  1  1
          1.37120853          1.00000000
  1  0  0  1  1
          0.51908460          1.00000000
  1  0  0  1  1
          0.07453289          1.00000000
  1  0  0  1  1
          0.02823360          1.00000000
# BERYLLIUM   (10s) -> [6s]
BE Ahlrichs-VTZ
  6
  1  0  0  5  1
       6526.14777960          0.00043732
        978.35496417          0.00338821
        222.65865756          0.01756309
         63.01302828          0.07058048
         20.46872018          0.22263836
  1  0  0  1  1
          7.26924874          1.00000000
  1  0  0  1  1
          2.73937011          1.00000000
  1  0  0  1  1
          1.06157911          1.00000000
  1  0  0  1  1
          0.18158440          1.00000000
  1  0  0  1  1
          0.05882682          1.00000000
# BORON       (10s,6p) -> [6s,3p]
B  Ahlrichs-VTZ
  9
  1  0  0  5  1
       5658.49920000          0.00055208
        848.69703000          0.00426514
        193.13656000          0.02185317
         54.58631700          0.08457068
         17.60012600          0.24304764
  1  0  0  1  1
          6.12696180          1.00000000
  1  0  0  1  1
          2.22452700          1.00000000
  1  0  0  1  1
          0.55650352          1.00000000
  1  0  0  1  1
          0.23876229          1.00000000
  1  0  0  1  1
          0.08579396          1.00000000
  1  1  1  4  1
         22.45580200         -0.00502606
          5.10306750         -0.03282698
          1.49840960         -0.13140941
          0.50989073         -0.33125264
  1  1  1  1  1
          0.18191350          1.00000000
  1  1  1  1  1
          0.06482718          1.00000000
# CARBON      (10s,6p) -> [6s,3p]
C  Ahlrichs-VTZ
  9
  1  0  0  5  1
       8506.03840000          0.00053374
       1275.73290000          0.00412502
        290.31187000          0.02117134
         82.05620000          0.08241786
         26.47964100          0.24012858
  1  0  0  1  1
          9.24145850          1.00000000
  1  0  0  1  1
          3.36435300          1.00000000
  1  0  0  1  1
          0.87174164          1.00000000
  1  0  0  1  1
          0.36352352          1.00000000
  1  0  0  1  1
          0.12873135          1.00000000
  1  1  1  4  1
         34.70949600          0.00533010
          7.95908830          0.03586581
          2.37869720          0.14200299
          0.81540065          0.34203105
  1  1  1  1  1
          0.28953785          1.00000000
  1  1  1  1  1
          0.10084754          1.00000000
# NITROGEN    (10s,6p) -> [6s,3p]
N  Ahlrichs-VTZ
  9
  1  0  0  5  1
      11913.41675600         -0.00052297
       1786.72138340         -0.00404284
        406.59012834         -0.02077272
        114.92525065         -0.08118314
         37.10588342         -0.23871497
  1  0  0  1  1
         12.97167620          1.00000000
  1  0  0  1  1
          4.73022912          1.00000000
  1  0  0  1  1
          1.25251843          1.00000000
  1  0  0  1  1
          0.51260071          1.00000000
  1  0  0  1  1
          0.17939714          1.00000000
  1  1  1  4  1
         49.21875839          0.00555270
         11.34893530          0.03805462
          3.42850882          0.14941412
          1.17995126          0.34898187
  1  1  1  1  1
          0.41726123          1.00000000
  1  1  1  1  1
          0.14295131          1.00000000
# OXYGEN      (10s,6p) -> [6s,3p]
O  Ahlrichs-VTZ
  9
  1  0  0  5  1
      15902.64745900          0.00051500
       2384.95378290          0.00398198
        542.71957182          0.02047697
        153.40407874          0.08026237
         49.54571614          0.23766840
  1  0  0  1  1
         17.33964990          1.00000000
  1  0  0  1  1
          6.33033553          1.00000000
  1  0  0  1  1
          1.69958822          1.00000000
  1  0  0  1  1
          0.68954491          1.00000000
  1  0  0  1  1
          0.23936028          1.00000000
  1  1  1  4  1
         63.27052401          0.00607092
         14.62331229          0.04194769
          4.44895180          0.16156884
          1.52815132          0.35682779
  1  1  1  1  1
          0.52997316          1.00000000
  1  1  1  1  1
          0.17509446          1.00000000
# FLUORINE    (10s,6p) -> [6s,3p]
F  Ahlrichs-VTZ
  9
  1  0  0  5  1
      20450.48900000          0.00051103
       3066.95470000          0.00395188
        697.91003000          0.02033455
        197.27020000          0.07987648
         63.72834300          0.23775601
  1  0  0  1  1
         22.32180900          1.00000000
  1  0  0  1  1
          8.15576090          1.00000000
  1  0  0  1  1
          2.21142950          1.00000000
  1  0  0  1  1
          0.89038567          1.00000000
  1  0  0  1  1
          0.30696604          1.00000000
  1  1  1  4  1
         80.21802000          0.00637445
         18.58728100          0.04436019
          5.68445810          0.16880038
          1.95127810          0.36162979
  1  1  1  1  1
          0.67024114          1.00000000
  1  1  1  1  1
          0.21682252          1.00000000
# NEON        (10s,6p) -> [6s,3p]
NE Ahlrichs-VTZ
  9
  1  0  0  5  1
      25558.39832000         -0.00050573
       3832.94048040         -0.00391125
        872.21073777         -0.02013482
        246.53755414         -0.07922343
         79.65839486         -0.23675798
  1  0  0  1  1
         27.91979965          1.00000000
  1  0  0  1  1
         10.20713166          1.00000000
  1  0  0  1  1
          2.78831867          1.00000000
  1  0  0  1  1
          1.11539947          1.00000000
  1  0  0  1  1
          0.38234011          1.00000000
  1  1  1  4  1
         99.76096643          0.00656487
         23.16768895          0.04595815
          7.11338987          0.17349981
          2.44185744          0.36486075
  1  1  1  1  1
          0.83442063          1.00000000
  1  1  1  1  1
          0.26639881          1.00000000
# SODIUM      (12s,6p) -> [7s,2p]
NA Ahlrichs-VTZ
  9
  1  0  0  5  1
      48876.19814700          0.00030496
       7327.28637080          0.00236328
       1667.41946520          0.01226845
        471.58101196          0.04962518
        152.93669811          0.15949592
  1  0  0  1  1
         54.35585547          1.00000000
  1  0  0  2  1
         20.76522281          0.40072046
          8.35994957          0.18337373
  1  0  0  1  1
          2.14809459          1.00000000
  1  0  0  1  1
          0.68819414          1.00000000
  1  0  0  1  1
          0.06047710          1.00000000
  1  0  0  1  1
          0.02713409          1.00000000
  1  1  1  5  1
        137.96254761          0.00592646
         32.20910536          0.04254399
          9.97463791          0.16644535
          3.47809300          0.36814915
          1.22843715          0.45781035
  1  1  1  1  1
          0.41731936          1.00000000
# MAGNESIUM   (12s,6p) -> [7s,2p]
MG Ahlrichs-VTZ
  9
  1  0  0  5  1
      58088.34977800          0.00029218
       8708.11809980          0.00226442
       1981.62241820          0.01175604
        560.43985997          0.04756994
        181.72976108          0.15308048
  1  0  0  1  1
         64.60333573          1.00000000
  1  0  0  2  1
         24.74214467          0.39883561
         10.02466472          0.18188815
  1  0  0  1  1
          2.69474413          1.00000000
  1  0  0  1  1
          0.91145252          1.00000000
  1  0  0  1  1
          0.10689673          1.00000000
  1  0  0  1  1
          0.04009162          1.00000000
  1  1  1  5  1
        179.83372724          0.00538198
         42.11309666          0.03932575
         13.11735377          0.15749044
          4.62294354          0.35940561
          1.66857858          0.45516230
  1  1  1  1  1
          0.58547797          0.21970492
# ALUMINUM    (12s9p) -> [7s5p]
AL Ahlrichs-VTZ
 12
  1  0  0  5  1
      68090.41167700          0.00028413
      10207.54082200          0.00220207
       2322.80458540          0.01143344
        656.88653838          0.04628459
        212.96694104          0.14910566
  1  0  0  1  1
         75.72471659          1.00000000
  1  0  0  2  1
         29.07632002          0.41663518
         11.85962393          0.18978371
  1  0  0  1  1
          3.31621532          1.00000000
  1  0  0  1  1
          1.17547888          1.00000000
  1  0  0  1  1
          0.17520529          1.00000000
  1  0  0  1  1
          0.06475875          1.00000000
  1  1  1  5  1
        442.79182587          0.00163911
        104.75988837          0.01314352
         33.37597945          0.06149771
         12.30538796          0.18825909
          4.86424757          0.36062611
  1  1  1  1  1
          1.96040271          1.00000000
  1  1  1  1  1
          0.78436734          1.00000000
  1  1  1  1  1
          0.19014165          1.00000000
  1  1  1  1  1
          0.05587437          1.00000000
# SILICON     (12s,9p) -> [7s,5p]
SI Ahlrichs-VTZ
 12
  1  0  0  5  1
      79079.43400000          0.00026431
      11855.01000000          0.00204851
       2697.70510000          0.01063724
        762.87227000          0.04308248
        247.28455000          0.13898279
  1  0  0  1  1
         87.93124000          1.00000000
  1  0  0  2  1
         33.82328400          0.44071543
         13.86810800          0.20091165
  1  0  0  1  1
          3.99200170          1.00000000
  1  0  0  1  1
          1.46599250          1.00000000
  1  0  0  1  1
          0.25271086          1.00000000
  1  0  0  1  1
          0.09249167          1.00000000
  1  1  1  5  1
        483.02352000          0.00191615
        114.25081000          0.01530977
         36.38778600          0.07109436
         13.41170400          0.21243244
          5.28840330          0.38976302
  1  1  1  1  1
          2.13742190          1.00000000
  1  1  1  1  1
          0.86468463          1.00000000
  1  1  1  1  1
          0.25489855          1.00000000
  1  1  1  1  1
          0.07939703          1.00000000
# PHOSPHORUS  (12s,9p) -> [7s,5p]
P  Ahlrichs-VTZ
 12
  1  0  0  5  1
      91049.04952500          0.00025380
      13649.24886400          0.00196712
       3105.94320740          0.01021606
        878.25982630          0.04139916
        284.63392907          0.13375415
  1  0  0  1  1
        101.20610005          1.00000000
  1  0  0  2  1
         38.97784142          0.45416113
         16.04849407          0.20742198
  1  0  0  1  1
          4.72253391          1.00000000
  1  0  0  1  1
          1.78252219          1.00000000
  1  0  0  1  1
          0.33962968          1.00000000
  1  0  0  1  1
          0.12333860          1.00000000
  1  1  1  5  1
        528.44389328         -0.00228152
        124.97149951         -0.01818364
         39.79570925         -0.08394070
         14.65754497         -0.24604714
          5.75788928         -0.43655668
  1  1  1  1  1
          2.31232010          1.00000000
  1  1  1  1  1
          0.88993781          1.00000000
  1  1  1  1  1
          0.30467150          1.00000000
  1  1  1  1  1
          0.10078154          1.00000000
# SULFUR      (12s,9p) -> [7s,5p]
S  Ahlrichs-VTZ
 12
  1  0  0  5  1
     103953.95000000          0.00024743
      15583.78600000          0.00191777
       3546.12930000          0.00996100
       1002.68080000          0.04038643
        324.90288000          0.13067523
  1  0  0  1  1
        115.51225000          1.00000000
  1  0  0  2  1
         44.52821000          0.50403551
         18.39789200          0.23068051
  1  0  0  1  1
          5.51006830          1.00000000
  1  0  0  1  1
          2.12598670          1.00000000
  1  0  0  1  1
          0.43691893          1.00000000
  1  0  0  1  1
          0.15730851          1.00000000
  1  1  1  5  1
        606.69367000          0.00232296
        143.50696000          0.01857053
         45.74616000          0.08603274
         16.87291200          0.25248431
          6.63991960          0.44632742
  1  1  1  1  1
          2.67271350          1.00000000
  1  1  1  1  1
          1.00000890          1.00000000
  1  1  1  1  1
          0.35438942          1.00000000
  1  1  1  1  1
          0.11671305          1.00000000
# CHLORINE    (12s,9p) -> [7s,5p]
CL Ahlrichs-VTZ
 12
  1  0  0  5  1
     117805.79000000          0.00024181
      17660.26500000          0.00187427
       4018.59730000          0.00973629
       1136.22310000          0.03949475
        368.12062000          0.12797166
  1  0  0  1  1
        130.86154000          1.00000000
  1  0  0  2  1
         50.47901100          0.42874094
         20.91680500          0.19668493
  1  0  0  1  1
          6.35313880          1.00000000
  1  0  0  1  1
          2.49480140          1.00000000
  1  0  0  1  1
          0.54335948          1.00000000
  1  0  0  1  1
          0.19434366          1.00000000
  1  1  1  5  1
        681.06879000          0.00236589
        161.11359000          0.01894072
         51.38663700          0.08784513
         18.95851200          0.25707435
          3.00351580          0.37152361
  1  1  1  1  1
          7.45652930          1.00000000
  1  1  1  1  1
          1.06093610          1.00000000
  1  1  1  1  1
          0.39452023          1.00000000
  1  1  1  1  1
          0.13323279          1.00000000
# ARGON       (12s,9p) -> [7s,5p]
AR Ahlrichs-VTZ
 12
  1  0  0  5  1
     132594.74255000          0.00025484
      19877.21005100          0.00197533
       4523.05259890          0.01026246
       1278.80310450          0.04164867
        414.25618940          0.13513377
  1  0  0  1  1
        147.24194110          1.00000000
  1  0  0  2  1
         56.82615538          0.45141633
         23.60408598          0.20758832
  1  0  0  1  1
          7.25249520          1.00000000
  1  0  0  1  1
          2.88929799          1.00000000
  1  0  0  1  1
          0.65887983          1.00000000
  1  0  0  1  1
          0.23439561          1.00000000
  1  1  1  5  1
        828.33969804          0.00217730
        196.06510758          0.01759744
         62.68122758          0.08290592
         23.22507784          0.24934103
          9.21678155          0.45327281
  1  1  1  1  1
          3.75955330          1.00000000
  1  1  1  1  1
          1.43167859          1.00000000
  1  1  1  1  1
          0.51298266          1.00000000
  1  1  1  1  1
          0.16821487          1.00000000
# POTASSIUM   (14s,9p) -> [8s,5p]
K  Ahlrichs-VTZ
 13
  1  0  0  6  1
     182594.27324000         -0.00022775
      27369.00498600         -0.00176640
       6229.17379710         -0.00919497
       1764.58234860         -0.03745508
        577.05120588         -0.12204454
        210.24933364         -0.29898972
  1  0  0  2  1
         82.61783064         -0.40514697
         33.23318452         -0.29253151
  1  0  0  1  1
          8.10649021          1.00000000
  1  0  0  1  1
          3.33402588          1.00000000
  1  0  0  1  1
          0.84554422          1.00000000
  1  0  0  1  1
          0.32821627          1.00000000
  1  0  0  1  1
          0.03640353          1.00000000
  1  0  0  1  1
          0.01764629          1.00000000
  1  1  1  3  1
        891.05446872          0.00218429
        211.01581996          0.01758911
         67.67141238          0.08177747
  1  1  1  3  1
         25.27148810          0.24565632
         10.13895897          0.43398377
          4.20186272          0.36237665
  1  1  1  1  1
          1.60294672          1.00000000
  1  1  1  1  1
          0.61461253          1.00000000
  1  1  1  1  1
          0.22199301          1.00000000
# CALCIUM     (14s,9p) -> [8s,5p]
CA Ahlrichs-VTZ
 13
  1  0  0  6  1
     202698.95519000          0.00022296
      30382.46591500          0.00172932
       6915.08331500          0.00900226
       1959.02109840          0.03666989
        640.93602075          0.11940987
        233.97696836          0.29182526
  1  0  0  2  1
         92.28919831          0.40441528
         37.25447991          0.29631289
  1  0  0  1  1
          9.13198433          1.00000000
  1  0  0  1  1
          3.81778579          1.00000000
  1  0  0  1  1
          1.04934751          1.00000000
  1  0  0  1  1
          0.42865992          1.00000000
  1  0  0  1  1
          0.06282264          1.00000000
  1  0  0  1  1
          0.02601624          1.00000000
  1  1  1  3  1
       1019.76076380         -0.00205986
        241.59630759         -0.01665008
         77.63701208         -0.07776460
  1  1  1  3  1
         29.11541943         -0.24180561
         11.76259359         -0.43257799
          4.92289242         -0.36732482
  1  1  1  1  1
          1.92232572          1.00000000
  1  1  1  1  1
          0.75796197          1.00000000
  1  1  1  1  1
          0.28430199          1.00000000
# SCANDIUM    (14s,9p,5d) -> [8s,5p,3d]
SC Ahlrichs-VTZ
 16
  1  0  0  6  1
     224356.94297000          0.00021996
      33628.70606000          0.00170604
       7654.01714830          0.00888153
       2168.43965660          0.03618370
        709.62663857          0.11783927
        259.31731327          0.28791645
  1  0  0  2  1
        102.47803758          0.36705139
         41.44313969          0.27161996
  1  0  0  1  1
         10.20185562          1.00000000
  1  0  0  1  1
          4.30449827          1.00000000
  1  0  0  1  1
          1.22194574          1.00000000
  1  0  0  1  1
          0.49725181          1.00000000
  1  0  0  1  1
          0.07272808          1.00000000
  1  0  0  1  1
          0.02939383          1.00000000
  1  1  1  3  1
       1154.99095920          0.00201027
        273.70496612          0.01630507
         88.06932731          0.07652789
  1  1  1  3  1
         33.11076003          0.23950904
         13.43644075          0.43235380
          5.65809846          0.36969429
  1  1  1  1  1
          2.24367043          1.00000000
  1  1  1  1  1
          0.88798004          1.00000000
  1  1  1  1  1
          0.33282410          1.00000000
  1  2  2  3  1
         19.23852404          0.02705466
          5.11733059          0.13813250
          1.65498839          0.34895303
  1  2  2  1  1
          0.54017605          1.00000000
  1  2  2  1  1
          0.16210625          1.00000000
# TITANIUM    (14s,9p,5d) -> [8s,5p,3d]
TI Ahlrichs-VTZ
 16
  1  0  0  6  1
     247254.20472000         -0.00022396
      37060.74757700         -0.00173712
       8435.17003120         -0.00904390
       2389.82990200         -0.03685082
        782.23119870         -0.12004208
        286.06776406         -0.29336894
  1  0  0  2  1
        113.20644330         -0.39817815
         45.84572039         -0.29713034
  1  0  0  1  1
         11.32852481          1.00000000
  1  0  0  1  1
          4.81252194          1.00000000
  1  0  0  1  1
          1.39576587          1.00000000
  1  0  0  1  1
          0.56327895          1.00000000
  1  0  0  1  1
          0.08051296          1.00000000
  1  0  0  1  1
          0.03192646          1.00000000
  1  1  1  3  1
       1298.41621070          0.00202474
        307.75625781          0.01647259
         99.13123393          0.07766728
  1  1  1  3  1
         37.34530556          0.24328820
         15.21071260          0.44259359
          6.43689814          0.38049636
  1  1  1  1  1
          2.58439289          1.00000000
  1  1  1  1  1
          1.02299933          1.00000000
  1  1  1  1  1
          0.38233959          1.00000000
  1  2  2  3  1
         23.46575100          0.02654283
          6.33323007          0.13802285
          2.07640799          0.35327843
  1  2  2  1  1
          0.69041160          1.00000000
  1  2  2  1  1
          0.21092515          1.00000000
# VANADIUM    (14s,9p,5d) -> [8s,5p,3d]
V  Ahlrichs-VTZ
 16
  1  0  0  6  1
     271348.15944000          0.00021967
      40672.00507800          0.00170386
       9257.07613850          0.00887137
       2622.73287730          0.03615432
        858.59480185          0.11780891
        314.19418650          0.28802536
  1  0  0  2  1
        124.47862127          0.42757917
         50.46939931          0.32144231
  1  0  0  1  1
         12.51384691          1.00000000
  1  0  0  1  1
          5.34477581          1.00000000
  1  0  0  1  1
          1.57556313          1.00000000
  1  0  0  1  1
          0.63069033          1.00000000
  1  0  0  1  1
          0.08795444          1.00000000
  1  0  0  1  1
          0.03429692          1.00000000
  1  1  1  3  1
       1450.03193270         -0.00195174
        343.75049884         -0.01592201
        110.82521708         -0.07538526
  1  1  1  3  1
         41.82246455         -0.23665641
         17.08807371         -0.43346920
          7.26132189         -0.37433001
  1  1  1  1  1
          2.94581453          1.00000000
  1  1  1  1  1
          1.16502097          1.00000000
  1  1  1  1  1
          0.43399378          1.00000000
  1  2  2  3  1
         27.36033586          0.02664427
          7.45427655          0.13999436
          2.46322702          0.35761186
  1  2  2  1  1
          0.82499542          1.00000000
  1  2  2  1  1
          0.25262971          1.00000000
# CHROMIUM    (14s,9p,5d) -> [8s,5p,3d]
CR Ahlrichs-VTZ
 16
  1  0  0  6  1
     296910.38175000          0.00021632
      44503.29798100          0.00167789
      10129.08373100          0.00873677
       2869.81253950          0.03561401
        939.52851828          0.11612082
        343.87667562          0.28429366
  1  0  0  2  1
        136.27242081          0.39618805
         55.27493591          0.29934143
  1  0  0  1  1
         13.75371506          1.00000000
  1  0  0  1  1
          5.88930645          1.00000000
  1  0  0  1  1
          1.73667819          1.00000000
  1  0  0  1  1
          0.67619018          1.00000000
  1  0  0  1  1
          0.09218762          1.00000000
  1  0  0  1  1
          0.03612011          1.00000000
  1  1  1  3  1
       1608.87436700          0.00193645
        381.42987006          0.01583901
        123.01926841          0.07535015
  1  1  1  3  1
         46.44678213          0.23949451
         19.00349476          0.44099403
          8.08899654          0.38019976
  1  1  1  1  1
          3.30137039          1.00000000
  1  1  1  1  1
          1.28776241          1.00000000
  1  1  1  1  1
          0.46546844          1.00000000
  1  2  2  3  1
         27.54673373          0.03063326
          7.46479407          0.15604066
          2.43275243          0.37003058
  1  2  2  1  1
          0.78187818          1.00000000
  1  2  2  1  1
          0.21977378          1.00000000
# MANGANESE   (14s,9p,5d) -> [8s,5p,3d]
MN Ahlrichs-VTZ
 16
  1  0  0  6  1
     323081.74475000         -0.00021859
      48425.98714700         -0.00169554
      11021.92842100         -0.00882905
       3122.86516830         -0.03599386
       1022.57022110         -0.11736441
        374.56667732         -0.28725943
  1  0  0  2  1
        148.65013953         -0.38025988
         60.37905678         -0.28945411
  1  0  0  1  1
         15.06128904          1.00000000
  1  0  0  1  1
          6.48276872          1.00000000
  1  0  0  1  1
          1.95351315          1.00000000
  1  0  0  1  1
          0.77017850          1.00000000
  1  0  0  1  1
          0.10192025          1.00000000
  1  0  0  1  1
          0.03861975          1.00000000
  1  1  1  3  1
       1777.87868240         -0.00193316
        421.57754180         -0.01584401
        136.11333999         -0.07556898
  1  1  1  3  1
         51.50677863         -0.23597435
         21.15322544         -0.43718792
          9.04771442         -0.38024193
  1  1  1  1  1
          3.73085636          1.00000000
  1  1  1  1  1
          1.47053315          1.00000000
  1  1  1  1  1
          0.54391841          1.00000000
  1  2  2  3  1
         35.42481665          0.02827075
          9.78132821          0.15071665
          3.26707129          0.38158552
  1  2  2  1  1
          1.10282719          1.00000000
  1  2  2  1  1
          0.33748087          1.00000000
# IRON        (14s,9p,5d) -> [8s,5p,3d]
FE Ahlrichs-VTZ
 16
  1  0  0  6  1
     350644.12607000          0.00021930
      52557.10447700          0.00170109
      11962.15760300          0.00885852
       3389.29879020          0.03611937
       1109.94098140          0.11780528
        406.75892124          0.28846626
  1  0  0  2  1
        161.55419196          0.38162019
         65.67521118          0.29212575
  1  0  0  1  1
         16.42571322          1.00000000
  1  0  0  1  1
          7.09302818          1.00000000
  1  0  0  1  1
          2.15942851          1.00000000
  1  0  0  1  1
          0.84771349          1.00000000
  1  0  0  1  1
          0.11079496          1.00000000
  1  0  0  1  1
          0.04131680          1.00000000
  1  1  1  3  1
       1953.60453190          0.00193816
        463.29314066          0.01591620
        149.67493331          0.07614915
  1  1  1  3  1
         56.70711203          0.23624430
         23.34102887          0.43978885
         10.01139316          0.38362586
  1  1  1  1  1
          4.15640196          1.00000000
  1  1  1  1  1
          1.63695826          1.00000000
  1  1  1  1  1
          0.60376297          1.00000000
  1  2  2  3  1
         38.96644239          0.02788407
         10.79897088          0.14863135
          3.61297484          0.36912959
  1  2  2  1  1
          1.21302858          1.00000000
  1  2  2  1  1
          0.36523978          1.00000000
# COBALT      (14s,9p,5d) -> [8s,5p,3d]
CO Ahlrichs-VTZ
 16
  1  0  0  6  1
     379411.77461000         -0.00021548
      56868.93439600         -0.00167144
      12943.60846200         -0.00870445
       3667.45326010         -0.03549617
       1201.14045910         -0.11581023
        440.33919478         -0.28374608
  1  0  0  2  1
        175.00035297         -0.38404173
         71.19098155         -0.29545416
  1  0  0  1  1
         17.84900792          1.00000000
  1  0  0  1  1
          7.72760703          1.00000000
  1  0  0  1  1
          2.37080608          1.00000000
  1  0  0  1  1
          0.92628272          1.00000000
  1  0  0  1  1
          0.11908621          1.00000000
  1  0  0  1  1
          0.04378239          1.00000000
  1  1  1  3  1
       2137.60077680         -0.00190579
        506.97292174         -0.01567839
        163.87524881         -0.07522963
  1  1  1  3  1
         62.15189899         -0.23369231
         25.63233144         -0.43693103
         11.02073903         -0.38210863
  1  1  1  1  1
          4.60243415          1.00000000
  1  1  1  1  1
          1.81028322          1.00000000
  1  1  1  1  1
          0.66569224          1.00000000
  1  2  2  3  1
         42.92437278          0.02975487
         11.94080960          0.15885714
          4.00372105          0.38970618
  1  2  2  1  1
          1.34125669          0.49652611
  1  2  2  1  1
          0.40011242          0.32719933
# NICKEL      (14s,9p,5d) -> [8s,5p,3d]
NI Ahlrichs-VTZ
 16
  1  0  0  6  1
     409347.86899000          0.00021252
      61355.83925500          0.00164849
      13964.85812800          0.00858533
       3956.85986990          0.03501533
       1296.02904740          0.11427673
        475.27876516          0.28015250
  1  0  0  2  1
        188.98838775          0.39246284
         76.92873698          0.30331302
  1  0  0  1  1
         19.33182873          1.00000000
  1  0  0  1  1
          8.38763997          1.00000000
  1  0  0  1  1
          2.58943429          1.00000000
  1  0  0  1  1
          1.00713747          1.00000000
  1  0  0  1  1
          0.12732573          1.00000000
  1  0  0  1  1
          0.04618981          1.00000000
  1  1  1  3  1
       2329.83843860         -0.00184142
        552.60693015         -0.01517369
        178.71193584         -0.07300467
  1  1  1  3  1
         67.84175081         -0.23224845
         28.02803353         -0.43596047
         12.07646920         -0.38213786
  1  1  1  1  1
          5.06941867          1.00000000
  1  1  1  1  1
          1.99118952          1.00000000
  1  1  1  1  1
          0.73006888          1.00000000
  1  2  2  3  1
         47.08830365          0.03152258
         13.14406723          0.16855326
          4.41585895          0.40930005
  1  2  2  1  1
          1.47699966          0.51501528
  1  2  2  1  1
          0.43728965          0.33962671
# COPPER      (14s,9p,5d) -> [8s,5p,3d]
CU Ahlrichs-VTZ
 16
  1  0  0  6  1
     441087.25070000         -0.00021814
      66112.02118700         -0.00169219
      15047.01142500         -0.00881371
       4263.42730840         -0.03595466
       1396.38157970         -0.11742970
        511.96055788         -0.28844267
  1  0  0  2  1
        203.45426948         -0.42678899
         82.79233703         -0.33044129
  1  0  0  1  1
         20.85428563          1.00000000
  1  0  0  1  1
          9.04106796          1.00000000
  1  0  0  1  1
          2.75181352          1.00000000
  1  0  0  1  1
          1.04348565          1.00000000
  1  0  0  1  1
          0.11172292          1.00000000
  1  0  0  1  1
          0.04104102          1.00000000
  1  1  1  3  1
       2530.09656710          0.00191379
        600.09792954          0.01579767
        194.08204479          0.07627126
  1  1  1  3  1
         73.67182138          0.23881452
         30.44736969          0.44980016
         13.12271488          0.39337682
  1  1  1  1  1
          5.52148400          1.00000000
  1  1  1  1  1
          2.14579221          1.00000000
  1  1  1  1  1
          0.76797489          1.00000000
  1  2  2  3  1
         47.31374370          0.03239976
         13.15468845          0.16822707
          4.36628857          0.38494430
  1  2  2  1  1
          1.41220659          1.00000000
  1  2  2  1  1
          0.38840713          1.00000000
# ZINC        (13s,9p,5d) -> [8s,5p,3d]
ZN Ahlrichs-VTZ
 16
  1  0  0  6  1
     472745.94164000         -0.00021701
      70858.09948400         -0.00168338
      16127.63973300         -0.00876775
       4569.76143200         -0.03576876
       1496.97653790         -0.11680699
        549.25646888         -0.28670653
  1  0  0  2  1
        218.59011012         -0.42684317
         89.06882333         -0.33251990
  1  0  0  1  1
         22.47575169          1.00000000
  1  0  0  1  1
          9.78369909          1.00000000
  1  0  0  1  1
          3.04760979          1.00000000
  1  0  0  1  1
          1.17513102          1.00000000
  1  0  0  1  1
          0.14336738          1.00000000
  1  0  0  1  1
          0.05076150          1.00000000
  1  1  1  3  1
       2738.99098490         -0.00187091
        649.72995198         -0.01546153
        210.29129074         -0.07475263
  1  1  1  3  1
         79.95436037         -0.23286955
         33.13129045         -0.44019360
         14.32639584         -0.38736391
  1  1  1  1  1
          6.06586466          1.00000000
  1  1  1  1  1
          2.37537196          1.00000000
  1  1  1  1  1
          0.86596317          1.00000000
  1  2  2  3  1
         56.07966480          0.02959823
         15.74825910          0.15879185
          5.30989277          0.37984178
  1  2  2  1  1
          1.77346525          1.00000000
  1  2  2  1  1
          0.51963234          1.00000000
# GALLIUM     (14s,11p,5p) -> [8s,6p,2d]
GA Ahlrichs-VTZ
 16
  1  0  0  6  1
     505335.63296000          0.00020974
      75742.78384400          0.00162697
      17239.46630500          0.00847412
       4884.93793620          0.03457115
       1600.54267360          0.11286666
        587.75692288          0.27673632
  1  0  0  2  1
        234.30109797          0.38518444
         95.61161803          0.30199565
  1  0  0  1  1
         24.16975022          1.00000000
  1  0  0  1  1
         10.57060341          1.00000000
  1  0  0  1  1
          3.38732467          1.00000000
  1  0  0  1  1
          1.33299479          1.00000000
  1  0  0  1  1
          0.19249282          1.00000000
  1  0  0  1  1
          0.07055192          1.00000000
  1  1  1  3  1
       2971.60789700          0.00159917
        705.19903787          0.01322248
        228.76520451          0.06379157
  1  1  1  3  1
         87.45639108          0.21775083
         36.54023197          0.41394919
         15.97457972          0.37538236
  1  1  1  1  1
          6.88706115          1.00000000
  1  1  1  2  1
          2.83185891          0.58552518
          1.10780100          0.33671543
  1  1  1  1  1
          0.23450859          1.00000000
  1  1  1  1  1
          0.06362688          1.00000000
  1  2  2  4  1
         65.34464181          0.02737834
         18.50057752          0.15105669
          6.31620584          0.37491843
          2.16388325          0.47510265
  1  2  2  1  1
          0.66688378          1.00000000
# GERMANIUM   (14s,11p,5d) -> [8s,6p,2d]
GE Ahlrichs-VTZ
 16
  1  0  0  6  1
     538981.20859000         -0.00021201
      80785.76895400         -0.00164460
      18387.32153900         -0.00856607
       5210.33695140         -0.03494637
       1707.48907720         -0.11406152
        627.54854073         -0.27936328
  1  0  0  2  1
        250.56696133         -0.39100943
        102.39333101         -0.30845092
  1  0  0  1  1
         25.92392334          1.00000000
  1  0  0  1  1
         11.38908119          1.00000000
  1  0  0  1  1
          3.74728089          1.00000000
  1  0  0  1  1
          1.50277333          1.00000000
  1  0  0  1  1
          0.24441034          1.00000000
  1  0  0  1  1
          0.09120539          1.00000000
  1  1  1  3  1
       3196.85712120          0.00150930
        758.78574707          0.01248854
        246.40186162          0.06025329
  1  1  1  3  1
         94.42908948          0.22636610
         39.60233327          0.43152372
         17.39402322          0.39496423
  1  1  1  1  1
          7.54688724          1.00000000
  1  1  1  2  1
          3.14979478          0.59773653
          1.26514858          0.34946773
  1  1  1  1  1
          0.30024032          1.00000000
  1  1  1  1  1
          0.08731919          1.00000000
  1  2  2  4  1
         74.77644790          0.02576022
         21.30776273          0.14540992
          7.34529660          0.37136368
          2.56568815          0.48003150
  1  2  2  1  1
          0.81988587          1.00000000
# ARSENIC     (14s,11p,5d) -> [8s,6p,2d]
AS Ahlrichs-VTZ
 16
  1  0  0  6  1
     573690.51140000         -0.00021423
      85988.18345500         -0.00166187
      19571.47427000         -0.00865618
       5546.03098040         -0.03531404
       1817.83619470         -0.11523139
        668.63675492         -0.28192647
  1  0  0  2  1
        267.38795948         -0.39133530
        109.41335253         -0.31052652
  1  0  0  1  1
         27.73776682          1.00000000
  1  0  0  1  1
         12.23852867          1.00000000
  1  0  0  1  1
          4.12659204          1.00000000
  1  0  0  1  1
          1.68350203          1.00000000
  1  0  0  1  1
          0.29954010          1.00000000
  1  0  0  1  1
          0.11318867          1.00000000
  1  1  1  3  1
       3425.09753580         -0.00147374
        813.08797098         -0.01220147
        264.28414769         -0.05885734
  1  1  1  3  1
        101.51263702         -0.20573149
         42.72235068         -0.39286344
         18.84511398         -0.36196398
  1  1  1  1  1
          8.22544553          1.00000000
  1  1  1  2  1
          3.47663635         -0.59644553
          1.42859183         -0.35023592
  1  1  1  1  1
          0.37149795          1.00000000
  1  1  1  1  1
          0.11244761          1.00000000
  1  2  2  4  1
         84.44262164          0.02452047
         24.18805173          0.14110224
          8.40378336          0.36874385
          2.98119494          0.48410290
  1  2  2  1  1
          0.97923124          1.00000000
# SELENIUM    (14s,11p,5d) -> [8s,6p,2d]
SE Ahlrichs-VTZ
 16
  1  0  0  6  1
     609461.56165000          0.00020666
      91349.72846900          0.00160315
      20791.84491000          0.00835041
       5892.00094020          0.03406659
       1931.57955230          0.11113200
        711.02173299          0.27160877
  1  0  0  2  1
        284.76563000          0.40353358
        116.67280336          0.32201538
  1  0  0  1  1
         29.61137985          1.00000000
  1  0  0  1  1
         13.11892160          1.00000000
  1  0  0  1  1
          4.52522746          1.00000000
  1  0  0  1  1
          1.87476785          1.00000000
  1  0  0  1  1
          0.35857738          1.00000000
  1  0  0  1  1
          0.13617744          1.00000000
  1  1  1  3  1
       3656.26581730          0.00147141
        868.08211673          0.01218823
        282.38879090          0.05878047
  1  1  1  3  1
        108.68249518          0.22385126
         45.88042837          0.42784038
         20.31363321          0.39569868
  1  1  1  1  1
          8.91386778          1.00000000
  1  1  1  2  1
          3.80294301          0.58895017
          1.59116635          0.34147004
  1  1  1  1  1
          0.44755579          1.00000000
  1  1  1  1  1
          0.13236319          1.00000000
  1  2  2  4  1
         94.49379399          0.02349045
         27.18650893          0.13749366
          9.50887420          0.36646763
          3.41754418          0.48752299
  1  2  2  1  1
          1.14814587          1.00000000
# BROMINE     (14s,11p,5d) -> [8s,6p,2d]
BR Ahlrichs-VTZ
 16
  1  0  0  6  1
     646312.41039000          0.00020844
      96873.03890000          0.00161696
      22048.96757400          0.00842249
       6248.35574820          0.03436088
       2048.74679770          0.11206361
        754.70826963          0.27360431
  1  0  0  2  1
        302.69689103          0.40561280
        124.16866898          0.32541501
  1  0  0  1  1
         31.54428107          1.00000000
  1  0  0  1  1
         14.02943598          1.00000000
  1  0  0  1  1
          4.94166792          1.00000000
  1  0  0  1  1
          2.07566180          1.00000000
  1  0  0  1  1
          0.42101474          1.00000000
  1  0  0  1  1
          0.16058114          1.00000000
  1  1  1  3  1
       3890.71817980          0.00151198
        923.85869493          0.01252930
        300.75537085          0.06040559
  1  1  1  3  1
        115.96376914          0.21102289
         49.09327108          0.40341288
         21.81039205          0.37386481
  1  1  1  1  1
          9.61901356          1.00000000
  1  1  1  2  1
          4.13415490          0.59931625
          1.75495989          0.33979400
  1  1  1  1  1
          0.52801532          1.00000000
  1  1  1  1  1
          0.15604838          1.00000000
  1  2  2  4  1
        104.85732970          0.02264931
         30.28008054          0.13456250
         10.65149713          0.36469675
          3.87058934          0.49046477
  1  2  2  1  1
          1.32429969          1.00000000
# KRYPTON     (14s,10p,5d) -> [8s,6p,2d]
KR Ahlrichs-VTZ
 16
  1  0  0  6  1
     684221.99700000          0.00020939
     102555.20043000          0.00162431
      23342.39377500          0.00846082
       6615.08355070          0.03451693
       2169.34386770          0.11254581
        799.69607957          0.27450859
  1  0  0  2  1
        321.18212105          0.33928755
        131.90111670          0.27359932
  1  0  0  1  1
         33.53647301          1.00000000
  1  0  0  1  1
         14.96988855          1.00000000
  1  0  0  1  1
          5.37553951          1.00000000
  1  0  0  1  1
          2.28584796          1.00000000
  1  0  0  1  1
          0.48690237          1.00000000
  1  0  0  1  1
          0.18641012          1.00000000
  1  1  1  3  1
       4128.69931990         -0.00156360
        980.47534405         -0.01296144
        319.40135820         -0.06246445
  1  1  1  3  1
        123.36181040         -0.21245677
         52.36231874         -0.40604316
         23.33542509         -0.37652208
  1  1  1  1  1
         10.34074505          1.00000000
  1  1  1  2  1
          4.46940780          0.55671931
          1.91778549          0.30604453
  1  1  1  1  1
          0.61259064          1.00000000
  1  1  1  1  1
          0.18236405          1.00000000
  1  2  2  4  1
        115.56236667          0.02194406
         33.47724715          0.13211460
         11.83479974          0.36327650
          4.34154927          0.49302860
  1  2  2  1  1
          1.50813570          1.00000000
# BASIS="Ahlrichs pVDZ"
#Elements                             References
#--------                             ----------
#H - Kr: A. Schafer, H. Horn and R. Ahlrichs, J. Chem. Phys. 97, 2571 (1992).
#Elements                             References
#--------                             ----------
#H - Kr: R. Ahlrichs and coworkers, (mostly unpublished)
#
# HYDROGEN    (4s) -> [2s]
# HYDROGEN    (1p)
H  Ahlrichs-pVDZ
  3
  1  0  0  3  1
         13.01070100          0.01968216
          1.96225720          0.13796524
          0.44453796          0.47831935
  1  0  0  1  1
          0.12194962          1.00000000
  1  1  1  1  1
          0.80000000          1.00000000
# HELIUM      (4s) -> [2s]
# HELIUM      (1p)
HE Ahlrichs-pVDZ
  3
  1  0  0  3  1
         38.35493674          0.02381429
          5.76890815          0.15490907
          1.23994070          0.46998097
  1  0  0  1  1
          0.29757816          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
# LITHIUM     (7s) -> [3s]
# LITHIUM     (1p)
LI Ahlrichs-pVDZ
  4
  1  0  0  5  1
        266.27785516          0.00649202
         40.06978345          0.04774786
          9.05599444          0.20268796
          2.45030091          0.48606575
          0.72209572          0.43626978
  1  0  0  1  1
          0.05281088          1.00000000
  1  0  0  1  1
          0.02096095          1.00000000
  1  1  1  1  1
          0.17000000          1.00000000
# BERYLLIUM   (7s) -> [3s]
# BERYLLIUM   (2p)
BE Ahlrichs-pVDZ
  5
  1  0  0  5  1
        515.18616125          0.00556153
         77.51103760          0.04119007
         17.55248169          0.17913378
          4.80289406          0.44736716
          1.45162143          0.42009582
  1  0  0  1  1
          0.13281634          1.00000000
  1  0  0  1  1
          0.04583737          1.00000000
  1  1  1  3  1
          3.63169171         -0.02903400
          0.71695694         -0.16877854
          0.19541933         -0.51403420
  1  1  1  1  1
          0.06051547          1.00000000
# BORON       (7s,4p) -> [3s,2p]
# BORON       (1d)
B  Ahlrichs-pVDZ
  6
  1  0  0  5  1
        839.31830086         -0.00559292
        126.26464843         -0.04156552
         28.62060076         -0.18299817
          7.87937227         -0.46540392
          2.40888572         -0.44173885
  1  0  0  1  1
          0.25105109          1.00000000
  1  0  0  1  1
          0.08364887          1.00000000
  1  1  1  3  1
          6.03322236         -0.03560367
          1.24991579         -0.19895776
          0.33871676         -0.50850203
  1  1  1  1  1
          0.09641563          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
# CARBON      (7s,4p) -> [3s,2p]
# CARBON      (1d)
C  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       1238.40169380          0.00545688
        186.29004992          0.04063841
         42.25117635          0.18025594
         11.67655793          0.46315122
          3.59305065          0.44087173
  1  0  0  1  1
          0.40245147          1.00000000
  1  0  0  1  1
          0.13090183          1.00000000
  1  1  1  3  1
          9.46809706          0.03838787
          2.01035451          0.21117025
          0.54771005          0.51328172
  1  1  1  1  1
          0.15268614          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (7s,4p) -> [3s,2p]
# NITROGEN    (1d)
N  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       1712.84158530         -0.00539341
        257.64812677         -0.04022158
         58.45824585         -0.17931145
         16.19836791         -0.46376318
          5.00526008         -0.44171423
  1  0  0  1  1
          0.58731857          1.00000000
  1  0  0  1  1
          0.18764592          1.00000000
  1  1  1  3  1
         13.57147023         -0.04007240
          2.92573729         -0.21807045
          0.79927751         -0.51294466
  1  1  1  1  1
          0.21954348          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# OXYGEN      (7s,4p) -> [3s,2p]
# OXYGEN      (1d)
O  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       2266.17677850         -0.00534318
        340.87010191         -0.03989004
         77.36313517         -0.17853912
         21.47964494         -0.46427685
          6.65894331         -0.44309745
  1  0  0  1  1
          0.80975976          1.00000000
  1  0  0  1  1
          0.25530772          1.00000000
  1  1  1  3  1
         17.72150432          0.04339457
          3.86355054          0.23094121
          1.04809209          0.51375311
  1  1  1  1  1
          0.27641544          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# FLUORINE    (7s,4p) -> [3s,2p]
# FLUORINE    (1d)
F  Ahlrichs-pVDZ
  6
  1  0  0  5  1
       2894.83259900         -0.00534083
        435.41939120         -0.03990426
         98.84332887         -0.17912768
         27.48519800         -0.46758091
          8.54054982         -0.44653131
  1  0  0  1  1
          1.06545780          1.00000000
  1  0  0  1  1
          0.33247347          1.00000000
  1  1  1  3  1
         22.69663392         -0.04521287
          4.98723393         -0.23754317
          1.34916140         -0.51287354
  1  1  1  1  1
          0.34829882          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# NEON        (7s,4p) -> [3s,2p]
# NEON        (1d)
NE Ahlrichs-pVDZ
  6
  1  0  0  5  1
       3598.97366250         -0.00532593
        541.32073112         -0.03981742
        122.90450062         -0.17914358
         34.21661702         -0.46893583
         10.65058412         -0.44782538
  1  0  0  1  1
          1.35459540          1.00000000
  1  0  0  1  1
          0.41919363          1.00000000
  1  1  1  3  1
         28.42405379         -0.04603194
          6.28225110         -0.23993183
          1.69787151         -0.50871725
  1  1  1  1  1
          0.43300700          1.00000000
  1  2  2  1  1
          1.88800000          1.00000000
# SODIUM      (10s,5p) -> [4s,1p]
# SODIUM      (1p)
NA Ahlrichs-pVDZ
  6
  1  0  0  5  1
       4098.20039080         -0.00585359
        616.49374031         -0.04364716
        139.96644001         -0.19431466
         39.07344105         -0.48685066
         11.92984721         -0.41881705
  1  0  0  3  1
         20.65996603          0.08594969
          1.98388610         -0.56359144
          0.64836324         -0.51954009
  1  0  0  1  1
          0.05244397          1.00000000
  1  0  0  1  1
          0.02804816          1.00000000
  1  1  1  5  1
         75.40186202          0.01543536
         17.27481898          0.09973829
          5.18423474          0.31209594
          1.66012120          0.49295675
          0.51232529          0.32420398
  1  1  1  1  1
          0.05200000          1.00000000
# MAGNESIUM   (10s,5p) -> [4s,1p]
# MAGNESIUM   (1p)
MG Ahlrichs-pVDZ
  6
  1  0  0  5  1
       4953.83391960         -0.00577790
        745.18044154         -0.04312476
        169.21604972         -0.19268217
         47.30067202         -0.48641439
         14.46133697         -0.42550894
  1  0  0  3  1
         24.76817479          0.08795697
          2.49409453         -0.55165058
          0.87807585         -0.53443295
  1  0  0  1  1
          0.08721278          1.00000000
  1  0  0  1  1
          0.03359929          1.00000000
  1  1  1  5  1
         98.05301049         -0.01448056
         22.58693228         -0.09549575
          6.83915098         -0.30787673
          2.23328438         -0.49936293
          0.71606599         -0.31503476
  1  1  1  1  1
          0.18914796          1.00000000
# ALUMINUM    (10s,7p) -> [4s,3p]
# ALUMINUM    (1d)
AL Ahlrichs-pVDZ
  8
  1  0  0  5  1
       5887.57270300          0.00134833
        885.61225996          0.01007158
        201.13604899          0.04513245
         56.28497467          0.11461268
         17.22955124          0.10159609
  1  0  0  3  1
         29.34024992          0.06934745
          3.04396304         -0.42528118
          1.12855395         -0.41449832
  1  0  0  1  1
          0.14234175          1.00000000
  1  0  0  1  1
          0.05440019          1.00000000
  1  1  1  5  1
        145.11918809          0.00639634
         33.71789483          0.04418936
         10.36986308          0.15581576
          3.51356160          0.28635287
          1.19800503          0.22921423
  1  1  1  1  1
          0.26583006          1.00000000
  1  1  1  1  1
          0.07100336          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
# SILICON     (10s,7p) -> [4s,3p]
# SILICON     (1d)
SI Ahlrichs-pVDZ
  8
  1  0  0  5  1
       6903.71186860          0.00133740
       1038.43464190          0.00999665
        235.87581480          0.04491017
         66.06938517          0.11463639
         20.24794576          0.10280064
  1  0  0  3  1
         34.35348173          0.07083729
          3.63707882         -0.43028836
          1.40020486         -0.41382775
  1  0  0  1  1
          0.20484415          1.00000000
  1  0  0  1  1
          0.07799410          1.00000000
  1  1  1  5  1
        179.83907373          0.00619167
         41.90725885          0.04339943
         12.95529437          0.15632019
          4.43832674          0.29419997
          1.54622479          0.23536824
  1  1  1  1  1
          0.35607612          1.00000000
  1  1  1  1  1
          0.10008514          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
# PHOSPHORUS  (10s,7p) -> [4s,3p]
# PHOSPHORUS  (1d)
P  Ahlrichs-pVDZ
  8
  1  0  0  5  1
       8002.47951060          0.00575035
       1203.68135900          0.04300763
        273.44227031          0.19363986
         76.65554152          0.49651693
         23.51692744          0.44983262
  1  0  0  3  1
         39.79168344          0.09518813
          4.27703433         -0.57649840
          1.69402569         -0.54239584
  1  0  0  1  1
          0.27567675          1.00000000
  1  0  0  1  1
          0.10495590          1.00000000
  1  1  1  5  1
        219.50755823          0.00921006
         51.27415503          0.06540977
         15.92159589          0.24033730
          5.50699135          0.46318322
          1.95377194          0.37392563
  1  1  1  1  1
          0.47803398          1.00000000
  1  1  1  1  1
          0.13657953          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# SULFUR      (10s,7p) -> [4s,3p]
# SULFUR      (1d)
S  Ahlrichs-pVDZ
  8
  1  0  0  5  1
       9184.93030100         -0.00222944
       1381.51055030         -0.01668303
        313.87147580         -0.07526244
         88.05387062         -0.19376827
         27.03991491         -0.17718021
  1  0  0  3  1
         45.64873130         -0.10736063
          4.96645223          0.65066293
          2.01162420          0.59712155
  1  0  0  1  1
          0.35661077          1.00000000
  1  0  0  1  1
          0.13507221          1.00000000
  1  1  1  5  1
        261.98233439         -0.00927299
         61.30689474         -0.06654767
         19.10372989         -0.24828596
          6.65677204         -0.48703847
          2.39596352         -0.39337850
  1  1  1  1  1
          0.61776162          1.00000000
  1  1  1  1  1
          0.16993377          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# CHLORINE    (10s,7p) -> [4s,3p]
# CHLORINE    (1d)
CL Ahlrichs-pVDZ
  8
  1  0  0  5  1
      10449.82756600          0.00197084
       1571.73652210          0.01475473
        357.12065523          0.06667911
        100.25185935          0.17228924
         30.81272755          0.15883786
  1  0  0  3  1
         51.92378943         -0.10009299
          5.70457610          0.60841753
          2.35083768          0.54352153
  1  0  0  1  1
          0.44605125          1.00000000
  1  0  0  1  1
          0.16848856          1.00000000
  1  1  1  5  1
        307.66790569         -0.00878015
         72.10201551         -0.06356336
         22.53268026         -0.24016428
          7.89917654         -0.47798867
          2.87672683         -0.38515850
  1  1  1  1  1
          0.77459364          1.00000000
  1  1  1  1  1
          0.21037700          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# ARGON       (10s,7p) -> [4s,3p]
# ARGON       (1d)
AR Ahlrichs-pVDZ
  8
  1  0  0  5  1
      11797.11976500          0.00202145
       1774.35227530          0.01513985
        403.18875733          0.06852540
        113.24933999          0.17762929
         34.83529819          0.16496495
  1  0  0  3  1
         58.61477504         -0.10343394
          6.49220451          0.63133366
          2.71170144          0.54887572
  1  0  0  1  1
          0.54412975          1.00000000
  1  0  0  1  1
          0.20517411          1.00000000
  1  1  1  5  1
        356.28707256         -0.00873218
         83.59313287         -0.06368032
         26.18670403         -0.24311907
          9.22572759         -0.48956070
          3.39227550         -0.39229190
  1  1  1  1  1
          0.94740534          1.00000000
  1  1  1  1  1
          0.25659135          1.00000000
  1  2  2  1  1
          0.96900000          1.00000000
# POTASSIUM   (14s,8p) -> [5s,2p]
# POTASSIUM   (1p)
K  Ahlrichs-pVDZ
  8
  1  0  0  6  1
      31478.74676400          0.00398387
       4726.88760660          0.03050176
       1075.43453530          0.15073753
        303.39811023          0.51912940
         98.32711283          1.03669570
         33.63622218          0.76398963
  1  0  0  3  1
         65.63920996         -0.28242617
          7.31625922          1.69149359
          2.89025801          1.29653320
  1  0  0  3  1
          4.54597490         -0.00763436
          0.70404124          0.02563572
          0.28266889          0.01660686
  1  0  0  1  1
          0.02905816          1.00000000
  1  0  0  1  1
          0.01211164          1.00000000
  1  1  1  5  1
        361.22492154          0.02090648
         84.67022217          0.15043642
         26.46908824          0.55440061
          9.26580776          1.04090100
          3.34233883          0.67825341
  1  1  1  3  1
          1.51008761          0.75248191
          0.56568375          1.37085850
          0.20817008          0.66047633
  1  1  1  1  1
          0.04173700          1.00000000
# CALCIUM     (14s,8p) -> [5s,2p]
# CALCIUM     (1p)
CA Ahlrichs-pVDZ
  8
  1  0  0  6  1
      35138.71392900          0.00394825
       5276.41113480          0.03023424
       1200.46925890          0.14952020
        338.71810542          0.51597346
        109.85385922          1.03395103
         37.60888030          0.76937934
  1  0  0  3  1
         73.10797755         -0.28268525
          8.24077057          1.67960921
          3.29598130          1.28037660
  1  0  0  3  1
          5.23418009         -0.00768686
          0.84187221          0.02538238
          0.36510294          0.01651217
  1  0  0  1  1
          0.05122240          1.00000000
  1  0  0  1  1
          0.01982511          1.00000000
  1  1  1  5  1
        413.11313893          0.02032714
         96.93578622          0.14730276
         30.37215466          0.54887167
         10.68477683          1.04406598
          3.88212583          0.68653491
  1  1  1  3  1
          1.79930163          0.75410247
          0.69189057          1.34092966
          0.26364024          0.56391989
  1  1  1  1  1
          0.07497900          1.00000000
# SCANDIUM    (14s,8p,5d) -> [5s,2p,2d]
# SCANDIUM    (1p)
SC Ahlrichs-pVDZ
 10
  1  0  0  6  1
      38956.08180400          0.00392932
       5849.57336370          0.03009322
       1330.88131540          0.14890371
        375.55534165          0.51464283
        121.87261370          1.03377081
         41.76024373          0.77436852
  1  0  0  3  1
         81.06063395         -0.28318552
          9.20598240          1.67708070
          3.70632157          1.25947337
  1  0  0  3  1
          5.98889100         -0.00778214
          0.97363432          0.02549969
          0.42041019          0.01619156
  1  0  0  1  1
          0.05944055          1.00000000
  1  0  0  1  1
          0.02289781          1.00000000
  1  1  1  5  1
        466.31481262          0.01998430
        109.51217097          0.14561043
         34.37592183          0.54687466
         12.14209696          1.04790060
          4.43367677          0.68894890
  1  1  1  3  1
          2.09712919          0.75619215
          0.80977607          1.31782122
          0.30834047          0.54312268
  1  2  2  4  1
         19.24033493          0.02703908
          5.11789959          0.13803685
          1.65542788          0.34869086
          0.54016356          0.48594186
  1  2  2  1  1
          0.16211215          1.00000000
  1  1  1  1  1
          0.08974800          1.00000000
# TITANIUM    (14s,8p,5d) -> [5s,2p,2d]
# TITANIUM    (1p)
TI Ahlrichs-pVDZ
 10
  1  0  0  6  1
      42961.51218500          0.00391276
       6450.97591690          0.02996982
       1467.72109150          0.14836353
        414.20997355          0.51347285
        134.48715840          1.03353655
         46.12220980          0.77854234
  1  0  0  3  1
         89.44776254         -0.28385401
         10.22334606          1.67727853
          4.13537743          1.24119285
  1  0  0  3  1
          6.78961815         -0.00784000
          1.11067307          0.02549549
          0.47565976          0.01606117
  1  0  0  1  1
          0.06598696          1.00000000
  1  0  0  1  1
          0.02521034          1.00000000
  1  1  1  5  1
        522.03684782          0.01975418
        122.68649489          0.14460678
         38.57290361          0.54669004
         13.67216932          1.05316475
          5.01185294          0.69111213
  1  1  1  3  1
          2.41319283          0.75803437
          0.93252270          1.30362414
          0.35429058          0.53638653
  1  2  2  4  1
         23.46512596          0.02653638
          6.33325938          0.13796454
          2.07664899          0.35312644
          0.69027362          0.48647124
  1  2  2  1  1
          0.21088739          0.33026314
  1  1  1  1  1
          0.10156100          1.00000000
# VANADIUM    (14s,8p,5d) -> [5s,2p,2d]
# VANADIUM    (1p)
V  Ahlrichs-pVDZ
 10
  1  0  0  6  1
      47160.37606000          0.00144987
       7081.41108710          0.01110644
       1611.16212230          0.05500542
        454.72940551          0.19060253
        147.71321208          0.38435023
         50.69953895          0.29095547
  1  0  0  3  1
         98.26249267         -0.10942338
         11.29429310          0.64539490
          4.58533601          0.47117881
  1  0  0  3  1
          7.63596896         -0.22454949
          1.25398367          0.72594853
          0.53271935          0.45560583
  1  0  0  1  1
          0.07224624          1.00000000
  1  0  0  1  1
          0.02735809          1.00000000
  1  1  1  5  1
        580.55044988          0.00973151
        136.52341127          0.07153124
         42.98395882          0.27197688
         15.28279876          0.52618989
          5.62024952          0.34452533
  1  1  1  3  1
          2.74853864          0.34040396
          1.06185501          0.57983996
          0.40235519          0.23911643
  1  2  2  4  1
         27.35843402          0.02664193
          7.45406043          0.13995312
          2.46339178          0.35751067
          0.82480925          0.48488354
  1  2  2  1  1
          0.25257905          0.32332845
  1  1  1  1  1
          0.11124800          1.00000000
# CHROMIUM    (14s,8p,5d) -> [5s,2p,2d]
# CHROMIUM    (1p)
CR Ahlrichs-pVDZ
 10
  1  0  0  6  1
      51528.08634900          0.00144058
       7737.21034870          0.01103620
       1760.37484700          0.05467665
        496.87706544          0.18965038
        161.46520598          0.38295413
         55.46635227          0.29090051
  1  0  0  3  1
        107.54732999         -0.10932281
         12.40867190          0.64472599
          5.04236288          0.46262713
  1  0  0  3  1
          8.54616402         -0.22711013
          1.39004412          0.73301528
          0.56066603          0.44225565
  1  0  0  1  1
          0.07148371          1.00000000
  1  0  0  1  1
          0.02825069          1.00000000
  1  1  1  5  1
        640.48536096          0.00961267
        150.69711194          0.07088983
         47.50375530          0.27065259
         16.93412017          0.52437343
          6.24096806          0.34107995
  1  1  1  3  1
          3.08854632          0.33973987
          1.17910478          0.57272063
          0.43369774          0.24582728
  1  2  2  4  1
         27.55947943          0.03061249
          7.46870203          0.15593271
          2.43459036          0.36984421
          0.78244755          0.47071118
  1  2  2  1  1
          0.21995774          0.33941650
  1  1  1  1  1
          0.12067500          1.00000000
# MANGANESE   (14s,8p,5d) -> [5s,2p,2d]
# MANGANESE   (1p)
MN Ahlrichs-pVDZ
 10
  1  0  0  6  1
      56137.00903700          0.00143213
       8429.20639430          0.01097251
       1917.82772330          0.05438247
        541.36230198          0.18884335
        176.00069142          0.38198025
         60.50047701          0.29156773
  1  0  0  3  1
        117.17282882         -0.10933661
         13.59697337          0.64305039
          5.54839963          0.45848971
  1  0  0  3  1
          9.46628535         -0.22538977
          1.55950061          0.72307759
          0.65230206          0.45300722
  1  0  0  1  1
          0.08400373          1.00000000
  1  0  0  1  1
          0.03125610          1.00000000
  1  1  1  5  1
        706.00497535          0.00950555
        166.19728820          0.07035627
         52.45206191          0.27005557
         18.74693286          0.52574345
          6.92829916          0.34254033
  1  1  1  3  1
          3.47722049          0.33994074
          1.34069064          0.57203836
          0.50498803          0.23847606
  1  2  2  4  1
         35.42326493          0.02698530
          9.78142215          0.14383459
          3.26734888          0.36418958
          1.10264722          0.48152671
  1  2  2  1  1
          0.33743206          0.31458754
  1  1  1  1  1
          0.12765000          1.00000000
# IRON        (14s,8p,5d) -> [5s,2p,2d]
# IRON        (1p)
FE Ahlrichs-pVDZ
 10
  1  0  0  6  1
      60923.64064300          0.00143023
       9147.88939820          0.01095879
       2081.35059270          0.05433255
        587.55977067          0.18884995
        191.09043990          0.38253070
         65.73273011          0.29308336
  1  0  0  3  1
        127.25891928         -0.10964565
         14.83091301          0.64387631
          6.06533074          0.45472347
  1  0  0  3  1
         10.44994371         -0.22539640
          1.72452280          0.72164398
          0.71772177          0.44985493
  1  0  0  1  1
          0.09144983          1.00000000
  1  0  0  1  1
          0.03370669          1.00000000
  1  1  1  5  1
        773.43750995          0.00943257
        182.15149714          0.07002962
         57.54727276          0.26993652
         20.61498894          0.52700011
          7.63485579          0.34284148
  1  1  1  3  1
          3.87193280          0.33974403
          1.49247241          0.56842594
          0.56061285          0.23649366
  1  2  2  4  1
         38.96813342          0.02787966
         10.80006708          0.14858320
          3.61364580          0.36905479
          1.21299679          0.47745101
  1  2  2  1  1
          0.36524393          0.31418142
  1  1  1  1  1
          0.13491500          1.00000000
# COBALT      (14s,8p,5d) -> [5s,2p,2d]
# COBALT      (1p)
CO Ahlrichs-pVDZ
 10
  1  0  0  6  1
      65902.20825700          0.00142846
       9895.38960270          0.01094607
       2251.43057890          0.05428595
        635.61097084          0.18885179
        206.78820681          0.38301635
         71.17924297          0.29443551
  1  0  0  3  1
        137.77268040         -0.10990222
         16.11807924          0.64455537
          6.60303277          0.45116788
  1  0  0  3  1
         11.47991579         -0.22593847
          1.89564263          0.72231409
          0.78466232          0.44903812
  1  0  0  1  1
          0.09842577          1.00000000
  1  0  0  1  1
          0.03594574          1.00000000
  1  1  1  5  1
        843.64358575          0.00938661
        198.76386994          0.06988021
         62.85496310          0.27037070
         22.56284228          0.52904787
          8.37132091          0.34357030
  1  1  1  3  1
          4.28587198          0.34027999
          1.65080418          0.56693392
          0.61834231          0.23617980
  1  2  2  4  1
         42.92786761          0.02848779
         11.94253305          0.15206951
          4.00464957          0.37310914
          1.34131938          0.47549838
  1  2  2  1  1
          0.40015010          0.31346831
  1  1  1  1  1
          0.14130800          1.00000000
# NICKEL      (14s,8p,5d) -> [5s,2p,2d]
# NICKEL      (1p)
NI Ahlrichs-pVDZ
 10
  1  0  0  6  1
      71074.80321100          0.00142604
      10672.02094100          0.01092824
       2428.13890070          0.05421263
        685.53595148          0.18874769
        223.10072863          0.38324617
         76.84201404          0.29550637
  1  0  0  3  1
        148.71122016         -0.11014443
         17.45915499          0.64521427
          7.16252807          0.44797838
  1  0  0  3  1
         12.55613713         -0.22645403
          2.07357405          0.72320959
          0.85382641          0.44868026
  1  0  0  1  1
          0.10536766          1.00000000
  1  0  0  1  1
          0.03813409          1.00000000
  1  1  1  5  1
        916.73608662          0.00934396
        216.06139913          0.06973737
         68.38391482          0.27073495
         24.59384395          0.53078302
          9.13929602          0.34410229
  1  1  1  3  1
          4.71933717          0.34076082
          1.81618492          0.56580170
          0.67840751          0.23616717
  1  2  2  4  1
         47.09383211          0.02898232
         13.14646397          0.15494996
          4.41705489          0.37633115
          1.47715651          0.47365096
  1  2  2  1  1
          0.43735922          0.31247838
  1  1  1  1  1
          0.14658800          1.00000000
# COPPER      (14s,8p,5d) -> [5s,2p,2d]
# COPPER      (1p)
CU Ahlrichs-pVDZ
 10
  1  0  0  6  1
      76381.34805600          0.00143361
      11468.77749900          0.01098675
       2609.42464950          0.05451365
        736.75033098          0.18990128
        239.82419958          0.38581959
         82.65682925          0.29790607
  1  0  0  3  1
        160.13544196         -0.11146779
         18.83417770          0.65349301
          7.71765957          0.44770534
  1  0  0  3  1
         13.71084672         -0.22870911
          2.23498957          0.73464423
          0.87818360          0.43273071
  1  0  0  1  1
          0.08718746          1.00000000
  1  0  0  1  1
          0.03296911          1.00000000
  1  1  1  5  1
        991.24075782          0.00938785
        233.69376116          0.07020828
         74.02093093          0.27323522
         26.66496745          0.53580793
          9.91920875          0.34575795
  1  1  1  3  1
          5.15195539          0.34229108
          1.96382058          0.56456592
          0.71560097          0.24078584
  1  2  2  4  1
         47.33504959          0.03237555
         13.16166608          0.16810219
          4.36937772          0.38477708
          1.41329251          0.46147880
  1  2  2  1  1
          0.38878001          0.32388873
  1  1  1  1  1
          0.15506500          1.00000000
# ZINC        (13s,8p,5d) -> [5s,2p,2d]
# ZINC        (1p)
ZN Ahlrichs-pVDZ
 10
  1  0  0  6  1
      82000.71162900          0.00142108
      12312.47177700          0.01089150
       2801.39441930          0.05405719
        790.99424302          0.18847464
        257.56551079          0.38346549
         88.81493340          0.29723794
  1  0  0  3  1
        171.86353716         -0.11051850
         20.30253478          0.64607717
          8.34641231          0.44220117
  1  0  0  3  1
         14.84753694         -0.22705309
          2.44950295          0.72433218
          0.99845822          0.44836496
  1  0  0  1  1
          0.11891308          1.00000000
  1  0  0  1  1
          0.04229743          1.00000000
  1  1  1  5  1
       1071.51853720          0.00927678
        252.69712152          0.06954115
         80.10082913          0.27156773
         28.90339317          0.53401356
         10.76889988          0.34501323
  1  1  1  3  1
          5.64462125          0.34129600
          2.16782913          0.56390522
          0.80540898          0.23676110
  1  2  2  4  1
         56.08893919          0.02958887
         15.75190892          0.15872571
          5.31158124          0.37976229
          1.77379049          0.46898959
  1  2  2  1  1
          0.51975584          0.30907149
  1  1  1  1  1
          0.16245500          1.00000000
# GALLIUM     (14s,10p,5d) -> [5s,4p,2d]
# GALLIUM     (1d)
GA Ahlrichs-pVDZ
 12
  1  0  0  6  1
      87842.12629600          0.00142716
      13189.49640200          0.01093889
       3000.94821410          0.05430820
        847.38425966          0.18951056
        276.00980642          0.38615186
         95.21667207          0.30051083
  1  0  0  3  1
        184.00703968         -0.11124462
         21.82705143          0.64831323
          9.00269638          0.44358384
  1  0  0  3  1
         16.03317694         -0.23014300
          2.67077249          0.72946862
          1.12528342          0.46214977
  1  0  0  1  1
          0.15967609          1.00000000
  1  0  0  1  1
          0.05764304          1.00000000
  1  1  1  5  1
       1167.26658440          0.00909740
        275.38062789          0.06845627
         87.37507307          0.26922294
         31.59725467          0.53507898
         11.82412280          0.35279063
  1  1  1  3  1
          6.28818451          0.33938245
          2.51998532          0.56871948
          1.01697263          0.27717695
  1  1  1  1  1
          0.24748374          1.00000000
  1  1  1  1  1
          0.06668529          1.00000000
  1  2  2  4  1
         65.35423767          0.02737015
         18.50465675          0.15099464
          6.31796206          0.37485329
          2.16413894          0.47510607
  1  2  2  1  1
          0.66693093          0.29843287
  1  2  2  1  1
          0.20700000          1.00000000
# GERMANIUM   (14s,10p,5d) -> [5s,4p,2d]
# GERMANIUM   (1d)
GE Ahlrichs-pVDZ
 12
  1  0  0  6  1
      93889.83664200          0.00142340
      14097.49752800          0.01091080
       3207.54773090          0.05418371
        905.76727269          0.18922820
        295.11014693          0.38612847
        101.84713141          0.30164051
  1  0  0  3  1
        196.56719662         -0.11118771
         23.40529252          0.64616007
          9.68391167          0.44188905
  1  0  0  3  1
         17.26973654         -0.23027421
          2.89646222          0.73017169
          1.25536214          0.46197222
  1  0  0  1  1
          0.20213081          1.00000000
  1  0  0  1  1
          0.07386791          1.00000000
  1  1  1  5  1
       1259.20859950          0.00901155
        297.15626382          0.06798684
         94.35338752          0.26853856
         34.17632968          0.53659649
         12.81613962          0.35633515
  1  1  1  3  1
          6.84710298          0.33900693
          2.77173639          0.56809365
          1.14584182          0.27246540
  1  1  1  1  1
          0.30679632          1.00000000
  1  1  1  1  1
          0.08928364          1.00000000
  1  2  2  4  1
         74.78216818          0.02575586
         21.31084976          0.14536816
          7.34647924          0.37134210
          2.56562714          0.48002998
  1  2  2  1  1
          0.81981773          0.28978791
  1  2  2  1  1
          0.24600000          1.00000000
# ARSENIC     (14s,10p,5d) -> [5s,4p,2d]
# ARSENIC     (1d)
AS Ahlrichs-pVDZ
 12
  1  0  0  6  1
     100146.52554000          0.00142583
      15036.86171100          0.01093018
       3421.29028330          0.05429417
        966.16965717          0.18976078
        314.87394026          0.38775195
        108.70823790          0.30402812
  1  0  0  3  1
        209.54238950         -0.11162094
         25.03822114          0.64697608
         10.39096434          0.44223609
  1  0  0  3  1
         18.55509009         -0.22994191
          3.12812174          0.73319108
          1.38848851          0.45533654
  1  0  0  1  1
          0.24714362          1.00000000
  1  0  0  1  1
          0.09142943          1.00000000
  1  1  1  5  1
       1355.64435070          0.00891825
        319.99929270          0.06745475
        101.67734092          0.26759772
         36.88632384          0.53776845
         13.86111591          0.35992570
  1  1  1  3  1
          7.42606669          0.34036850
          3.03162472          0.57030149
          1.27830783          0.26606170
  1  1  1  1  1
          0.37568503          1.00000000
  1  1  1  1  1
          0.11394805          1.00000000
  1  2  2  4  1
         84.44551454          0.02451840
         24.19041610          0.14107455
          8.40450151          0.36875229
          2.98089707          0.48409561
  1  2  2  1  1
          0.97909243          0.28250269
  1  2  2  1  1
          0.29300000          1.00000000
# SELENIUM    (14s,10p,5d) -> [5s,4p,2d]
# SELENIUM    (1d)
SE Ahlrichs-pVDZ
 12
  1  0  0  6  1
     106612.20027000          0.00142749
      16007.60470100          0.01094353
       3642.16997070          0.05437417
       1028.59129930          0.19018093
        335.30298888          0.38913022
        115.80129154          0.30620207
  1  0  0  3  1
        222.93325020         -0.11198808
         26.72625793          0.64752124
         11.12450192          0.44241977
  1  0  0  3  1
         19.88852006         -0.22857228
          3.36684738          0.73591360
          1.52492778          0.44330200
  1  0  0  1  1
          0.29630038          1.00000000
  1  0  0  1  1
          0.11009289          1.00000000
  1  1  1  5  1
       1455.90681200          0.00882036
        343.75101831          0.06687585
        109.29554964          0.26640578
         39.70771102          0.53834928
         14.95018523          0.36303282
  1  1  1  3  1
          8.02089621          0.34153807
          3.29346498          0.57257907
          1.40586024          0.25549813
  1  1  1  1  1
          0.45076123          1.00000000
  1  1  1  1  1
          0.13353413          1.00000000
  1  2  2  4  1
         94.49402404          0.02349010
         27.18818526          0.13747736
          9.50915674          0.36649929
          3.41705169          0.48750990
  1  2  2  1  1
          1.14795901          0.27657943
  1  2  2  1  1
          0.33800000          1.00000000
# BROMINE     (14s,10p,5d) -> [5s,4p,2d]
# BROMINE     (1d)
BR Ahlrichs-pVDZ
 12
  1  0  0  6  1
     113286.38776000          0.00142830
      17009.62630300          0.01095042
       3870.18425670          0.05442101
       1093.03572270          0.19047908
        356.39721797          0.39024643
        123.12539643          0.30814433
  1  0  0  3  1
        236.74084007         -0.11228066
         28.46866107          0.64775962
         11.88344372          0.44235576
  1  0  0  3  1
         21.26963331         -0.22642576
          3.61292268          0.73823712
          1.66266490          0.42683869
  1  0  0  1  1
          0.34823793          1.00000000
  1  0  0  1  1
          0.13019031          1.00000000
  1  1  1  5  1
       1560.28018810          0.00871667
        368.47859205          0.06624364
        117.22978849          0.26495610
         42.64890925          0.53839161
         16.08722510          0.36579388
  1  1  1  3  1
          8.63528101          0.34248787
          3.56136655          0.57500678
          1.52926266          0.24330394
  1  1  1  1  1
          0.53064295          1.00000000
  1  1  1  1  1
          0.15702759          1.00000000
  1  2  2  4  1
        104.85518642          0.02265015
         30.28114369          0.13455483
         10.65139427          0.36474455
          3.86994562          0.49044587
  1  2  2  1  1
          1.32408768          0.27137289
  1  2  2  1  1
          0.38900000          1.00000000
# KRYPTON     (14s,10p,5d) -> [5s,4p,2d]
# KRYPTON     (1d)
KR Ahlrichs-pVDZ
 12
  1  0  0  6  1
     120165.64875000          0.00142942
      18042.50016900          0.01095960
       4105.18003880          0.05447965
       1159.44472480          0.19081239
        378.13810346          0.39140446
        130.67610045          0.31007347
  1  0  0  3  1
        250.96373353         -0.11258604
         30.26593038          0.64816323
         12.66811076          0.44240239
  1  0  0  3  1
         22.69794010         -0.22391965
          3.86730174          0.74060953
          1.80137067          0.40803658
  1  0  0  1  1
          0.40308639          1.00000000
  1  0  0  1  1
          0.15170528          1.00000000
  1  1  1  5  1
       1668.57366230          0.00862150
        394.13862798          0.06566551
        125.46644854          0.26366577
         45.70499273          0.53867659
         17.27013323          0.36865168
  1  1  1  3  1
          9.26994878          0.34346189
          3.83646177          0.57784776
          1.64671633          0.23075615
  1  1  1  1  1
          0.61479686          1.00000000
  1  1  1  1  1
          0.18319467          1.00000000
  1  2  2  4  1
        115.55868603          0.02194549
         33.47798586          0.13211213
         11.83445021          0.36333307
          4.34082549          0.49300484
  1  2  2  1  1
          1.50792732          0.26676859
  1  2  2  1  1
          0.44300000          1.00000000
# BASIS="Ahlrichs TZV"
#Elements                             References
#--------                             ----------
#Li - Kr: A. Schafer, C. Huber and R. Ahlrichs, J. Chem. Phys. 100, 5829 (1994).
#H,He added from VTZ (Joost)
#
# HYDROGEN    (5s) -> [3s]
H  Ahlrichs-TZV
  3
  1  0  0  3  1
         34.06134100          0.00602520
          5.12357460          0.04502109
          1.16466260          0.20189726
  1  0  0  1  1
          0.32723041          1.00000000
  1  0  0  1  1
          0.10307241          1.00000000
# HELIUM      (5s) -> [3s]
HE Ahlrichs-TZV
  3
  1  0  0  3  1
         98.07832162          0.00758031
         14.76440425          0.05484862
          3.31858315          0.22074382
  1  0  0  1  1
          0.87413870          1.00000000
  1  0  0  1  1
          0.24459897          1.00000000
# LITHIUM     (11s) -> [5s]
LI Ahlrichs-TZV
  5
  1  0  0  6  1
       6269.26280100          0.00020541
        940.31612431          0.00159166
        214.22107528          0.00828698
         60.75984018          0.03385637
         19.91515203          0.11103226
          7.31715098          0.27449383
  1  0  0  2  1
          2.97246742          0.23792456
          1.26398523          0.30765412
  1  0  0  1  1
          0.51427490          1.00000000
  1  0  0  1  1
          0.07703089          1.00000000
  1  0  0  1  1
          0.02893890          1.00000000
# BERYLLIUM   (11s) -> [5s]
BE Ahlrichs-TZV
  5
  1  0  0  6  1
       4700.23656260          0.00023584
        704.82845622          0.00182438
        160.43110478          0.00939661
         45.42534734          0.03690892
         14.79833412          0.10897561
          5.35124525          0.21694285
  1  0  0  2  1
          2.15420448          0.44695409
          0.93363744          0.20866986
  1  0  0  1  1
          0.18791433          1.00000000
  1  0  0  1  1
          0.74648268          1.00000000
  1  0  0  1  1
          0.03265048          1.00000000
# BORON       (11s,6p) -> [5s,3p]
B  Ahlrichs-TZV
  8
  1  0  0  6  1
       8564.86606870          0.00022837
       1284.15162630          0.00176826
        292.27871604          0.00914071
         82.77546918          0.03634264
         27.01793927          0.11063458
          9.81496197          0.23367344
  1  0  0  2  1
          3.93185591          0.41818778
          1.65955997          0.22325474
  1  0  0  1  1
          0.35762965          1.00000000
  1  0  0  1  1
          0.14246277          1.00000000
  1  0  0  1  1
          0.06056059          1.00000000
  1  1  1  4  1
         22.45387580          0.00502656
          5.10450583          0.03280174
          1.49860813          0.13151231
          0.50927831          0.33197168
  1  1  1  1  1
          0.18147078          1.00000000
  1  1  1  1  1
          0.06462189          1.00000000
# CARBON      (11s,6p) -> [5s,3p]
C  Ahlrichs-TZV
  8
  1  0  0  6  1
      13575.34968200          0.00022246
       2035.23336800          0.00172327
        463.22562359          0.00892557
        131.20019598          0.03572798
         42.85301589          0.11076260
         15.58418577          0.24295628
  1  0  0  2  1
          6.20671385          0.41440263
          2.57648965          0.23744969
  1  0  0  1  1
          0.57696339          1.00000000
  1  0  0  1  1
          0.22972831          1.00000000
  1  0  0  1  1
          0.09516444          1.00000000
  1  1  1  4  1
         34.69723224          0.00533337
          7.95826228          0.03586411
          2.37808269          0.14215873
          0.81433208          0.34270472
  1  1  1  1  1
          0.28887547          1.00000000
  1  1  1  1  1
          0.10056824          1.00000000
# NITROGEN    (11s,6p) -> [5s,3p]
N  Ahlrichs-TZV
  8
  1  0  0  6  1
      19730.80064700          0.00021888
       2957.89587450          0.00169607
        673.22133595          0.00879546
        190.68249494          0.03535938
         62.29544190          0.11095789
         22.65416118          0.24982973
  1  0  0  2  1
          8.97914774          0.40623896
          3.68630024          0.24338217
  1  0  0  1  1
          0.84660077          1.00000000
  1  0  0  1  1
          0.33647134          1.00000000
  1  0  0  1  1
          0.13647654          1.00000000
  1  1  1  4  1
         49.20038051          0.00555524
         11.34679054          0.03805238
          3.42739724          0.14953671
          1.17855251          0.34949305
  1  1  1  1  1
          0.41642205          1.00000000
  1  1  1  1  1
          0.14260826          1.00000000
# OXYGEN      (11s,6p) -> [5s,3p]
O  Ahlrichs-TZV
  8
  1  0  0  6  1
      27032.38263100          0.00021726
       4052.38713920          0.00168387
        922.32722710          0.00873956
        261.24070989          0.03523997
         85.35464135          0.11153519
         31.03503524          0.25588954
  1  0  0  2  1
         12.26086073          0.39768731
          4.99870760          0.24627849
  1  0  0  1  1
          1.17031082          1.00000000
  1  0  0  1  1
          0.46474741          1.00000000
  1  0  0  1  1
          0.18504536          1.00000000
  1  1  1  4  1
         63.27495480          0.00606851
         14.62704938          0.04191258
          4.45012235          0.16153841
          1.52757996          0.35706951
  1  1  1  1  1
          0.52935118          1.00000000
  1  1  1  1  1
          0.17478421          1.00000000
# FLUORINE    (11s,6p) -> [5s,3p]
F  Ahlrichs-TZV
  8
  1  0  0  6  1
      35479.10044100          0.00021545
       5318.47289830          0.00167007
       1210.48109750          0.00867332
        342.85518140          0.03504993
        112.01943181          0.11165320
         40.71474025          0.25988507
  1  0  0  2  1
         16.03967811          0.39422967
          6.50381867          0.24998239
  1  0  0  1  1
          1.54404775          1.00000000
  1  0  0  1  1
          0.61223453          1.00000000
  1  0  0  1  1
          0.24027980          1.00000000
  1  1  1  4  1
         80.23390048          0.00636860
         18.59401074          0.04430314
          5.68679027          0.16867249
          1.95110063          0.36166346
  1  1  1  1  1
          0.66970211          1.00000000
  1  1  1  1  1
          0.21651300          1.00000000
# NEON        (11s,6p) -> [5s,3p]
NE Ahlrichs-TZV
  8
  1  0  0  6  1
      45069.46402200          0.00021687
       6755.97686560          0.00168127
       1537.65028640          0.00873561
        435.51697667          0.03536127
        142.28655638          0.11321521
         51.69215380          0.26654653
  1  0  0  2  1
         20.31587049          0.39631960
          8.20219426          0.25582811
  1  0  0  1  1
          1.96812763          1.00000000
  1  0  0  1  1
          0.77904756          1.00000000
  1  0  0  1  1
          0.30229502          1.00000000
  1  1  1  4  1
         99.78299603          0.00655692
         23.17612410          0.04588801
          7.11639459          0.17331288
          2.44187114          0.36475268
  1  1  1  1  1
          0.83389606          1.00000000
  1  1  1  1  1
          0.26607311          1.00000000
# SODIUM      (14s,6p) -> [5s,2p]
NA Ahlrichs-TZV
  7
  1  0  0  7  1
      26041.10992700          0.00061806
       3906.12685480          0.00477486
        888.97454993          0.02447168
        251.45497961          0.09475539
         81.65014351          0.26867497
         28.90415840          0.47925475
         10.62578293          0.33248591
  1  0  0  3  1
         53.76941018          0.01952773
         16.30824302          0.09264801
          2.37303841         -0.39938670
  1  0  0  2  1
          0.95730773          1.64285954
          0.40806461          0.55692597
  1  0  0  1  1
          0.04996758          1.00000000
  1  0  0  1  1
          0.01926862          1.00000000
  1  1  1  5  1
        138.07979989          0.00579519
         32.23270039          0.04162085
          9.98160754          0.16281917
          3.48220339          0.36011785
          1.22991346          0.44858980
  1  1  1  1  1
          0.41743959          1.00000000
# MAGNESIUM   (14s,6p) -> [5s,2p]
MG Ahlrichs-TZV
  7
  1  0  0  7  1
      31438.34955500          0.00060912
       4715.51533540          0.00470662
       1073.16292470          0.02413582
        303.57238768          0.09362896
         98.62625104          0.26646742
         34.94380842          0.47890930
         12.85978520          0.33698490
  1  0  0  3  1
         64.87691300          0.01918089
         19.72552078          0.09091370
          2.89518043         -0.39563756
  1  0  0  2  1
          1.19604547          1.68276034
          0.54329451          0.52141092
  1  0  0  1  1
          0.10099104          1.00000000
  1  0  0  1  1
          0.03686573          1.00000000
  1  1  1  5  1
        179.87189612          0.00537995
         42.12006938          0.03931801
         13.12050303          0.15740129
          4.62575036          0.35919094
          1.66952110          0.45533379
  1  1  1  1  1
          0.58551012          1.00000000
# ALUMINUM    (14s,9p) -> [5s,4p]
AL Ahlrichs-TZV
  9
  1  0  0  7  1
      37792.55077200          0.00057048
       5668.06821650          0.00440930
       1289.85828410          0.02263097
        364.86596028          0.08802564
        118.57631515          0.25223702
         42.02486760          0.45960547
         15.49950163          0.33277886
  1  0  0  3  1
         75.20802660          0.01925056
         23.03140897          0.08790674
          3.63487976         -0.34246705
  1  0  0  2  1
          1.60650500          1.51062661
          0.76103395          0.58071016
  1  0  0  1  1
          0.16556709          1.00000000
  1  0  0  1  1
          0.06004158          1.00000000
  1  1  1  6  1
        452.52303192          0.00231108
        107.08195049          0.01856864
         34.13102125          0.08721624
         12.58703743          0.26902102
          4.98119197          0.52128324
          2.00703509          0.60271687
  1  1  1  1  1
          0.80083714          1.00000000
  1  1  1  1  1
          0.20178927          1.00000000
  1  1  1  1  1
          0.05789555          1.00000000
# SILICON     (14s,9p) -> [5s,4p]
SI Ahlrichs-TZV
  9
  1  0  0  7  1
      44773.35807800          0.00055915
       6717.19921040          0.00432060
       1528.89603250          0.02218710
        432.54746585          0.08648925
        140.61505226          0.24939890
         49.85763672          0.46017197
         18.43497489          0.34250237
  1  0  0  3  1
         86.53388611          0.02130006
         26.62460685          0.09467614
          4.49530572         -0.32616265
  1  0  0  2  1
          2.10350457          1.39808039
          1.01060949          0.63865787
  1  0  0  1  1
          0.23701751          1.00000000
  1  0  0  1  1
          0.08570341          1.00000000
  1  1  1  6  1
        394.47503628          0.00262857
         93.13768310          0.02055626
         29.51960874          0.09207026
         10.78166379          0.25565890
          4.16265748          0.42111707
          1.62479730          0.34401746
  1  1  1  1  1
          0.54306660          1.00000000
  1  1  1  1  1
          0.20582074          1.00000000
  1  1  1  1  1
          0.07005349          1.00000000
# PHOSPHORUS  (14s,9p) -> [5s,4p]
P  Ahlrichs-TZV
  9
  1  0  0  7  1
      52426.99923300          0.00055207
       7863.26605520          0.00426786
       1789.52273330          0.02193153
        506.27300165          0.08566717
        164.60698546          0.24840687
         58.39191872          0.46336754
         21.64366320          0.35350558
  1  0  0  3  1
         99.01383762          0.02189568
         30.55043982          0.09565047
          5.45370877         -0.29454270
  1  0  0  2  1
          2.65033626          1.32943812
          1.27266889          0.66109396
  1  0  0  1  1
          0.31645005          1.00000000
  1  0  0  1  1
          0.11417467          1.00000000
  1  1  1  6  1
        472.27219248          0.00257106
        111.58882756          0.02025030
         35.44593642          0.09158072
         12.99077688          0.25749454
          5.04862217          0.42862900
          1.99340496          0.34359818
  1  1  1  1  1
          0.66527284          1.00000000
  1  1  1  1  1
          0.25516832          1.00000000
  1  1  1  1  1
          0.09035776          1.00000000
# SULFUR      (14s,9p) -> [5s,4p]
S  Ahlrichs-TZV
  9
  1  0  0  7  1
      60700.92810400          0.00054696
       9102.61068540          0.00422972
       2071.41660090          0.02174782
        586.02476821          0.08510005
        190.55395021          0.24799128
         67.63038426          0.46703640
         25.12730691          0.36434588
  1  0  0  3  1
        112.57463010          0.02167004
         34.79555422          0.09360230
          6.51155562         -0.26068001
  1  0  0  2  1
          3.23990323          1.28420894
          1.54771609          0.66036417
  1  0  0  1  1
          0.40541030          1.00000000
  1  0  0  1  1
          0.14550651          1.00000000
  1  1  1  6  1
        564.36716027          0.00247968
        133.42624379          0.01967793
         42.46827119          0.08998001
         15.61652758          0.25705881
          6.10939885          0.43515167
          2.44041602          0.34883241
  1  1  1  1  1
          0.83882201          1.00000000
  1  1  1  1  1
          0.31288747          1.00000000
  1  1  1  1  1
          0.10770109          1.00000000
# CHLORINE    (14s,9p) -> [5s,4p]
CL Ahlrichs-TZV
  9
  1  0  0  7  1
      69507.99094500          0.00054315
      10426.15688000          0.00419905
       2373.23340610          0.02159214
        671.56420071          0.08459885
        218.41999790          0.24757250
         77.57224971          0.47016930
         28.88881528          0.37436371
  1  0  0  3  1
        127.10527185          0.02518217
         39.33958296          0.10786112
          7.67406800         -0.27408822
  1  0  0  2  1
          3.87456276          1.32138750
          1.83858326          0.68636955
  1  0  0  1  1
          0.50229058          1.00000000
  1  0  0  1  1
          0.17962723          1.00000000
  1  1  1  6  1
        666.50423284          0.00236327
        157.64241690          0.01887930
         50.26252098          0.08720634
         18.53607811          0.25285613
          7.29405328          0.43507155
          2.94332490          0.35026513
  1  1  1  1  1
          1.04049708          1.00000000
  1  1  1  1  1
          0.38456415          1.00000000
  1  1  1  1  1
          0.13069643          1.00000000
# ARGON       (14s,9p) -> [5s,4p]
AR Ahlrichs-TZV
  9
  1  0  0  7  1
      79111.42299800          0.00051029
      11864.74600900          0.00394630
       2700.16429730          0.02030707
        763.95943485          0.07969183
        248.45150561          0.23420624
         88.28358100          0.44833849
         32.94860707          0.36408167
  1  0  0  3  1
        142.55358000          0.02638741
         44.16368801          0.11226434
          8.95249950         -0.26178922
  1  0  0  2  1
          4.55469209          1.30024850
          2.14440790          0.67197237
  1  0  0  1  1
          0.60708777          1.00000000
  1  0  0  1  1
          0.21651432          1.00000000
  1  1  1  6  1
        776.77541998          0.00220280
        183.80107018          0.01769418
         58.69400317          0.08243129
         21.70159170          0.24207279
          8.58214896          0.42263558
          3.49226792          0.34151806
  1  1  1  1  1
          1.26374270          1.00000000
  1  1  1  1  1
          0.46607870          1.00000000
  1  1  1  1  1
          0.15766003          1.00000000
# POTASSIUM   (17s,10p) -> [6s,3p]
K  Ahlrichs-TZV
  9
  1  0  0  8  1
     153976.18325000          0.00023663
      23082.49767200          0.00183429
       5253.23447450          0.00953105
       1486.95501330          0.03863841
        484.06333726          0.12480769
        173.56653980          0.29278861
         67.11638146          0.40633426
         26.33950205          0.20077216
  1  0  0  4  1
        172.87693567         -0.02420096
         53.05864906         -0.11553095
          7.92127540          0.57455545
          3.21088805          0.57023185
  1  0  0  2  1
          4.56620709         -0.22615763
          0.70209907          0.75528392
  1  0  0  1  1
          0.28258943          1.00000000
  1  0  0  1  1
          0.03580582          1.00000000
  1  0  0  1  1
          0.01581921          1.00000000
  1  1  1  6  1
        728.18449873          0.00261507
        172.13265061          0.02067363
         54.82984707          0.09320560
         20.16626649          0.25436518
          7.86107288          0.39131133
          3.11052131          0.22481346
  1  1  1  3  1
         11.75733749         -0.02577729
          1.51396174          0.57359429
          0.58328592          1.07983200
  1  1  1  1  1
          0.21570478          1.00000000
# CALCIUM     (17s,10p) -> [6s,3p]
CA Ahlrichs-TZV
  9
  1  0  0  8  1
     172517.32685000          0.00023318
      25861.51927500          0.00180765
       5885.66186680          0.00939438
       1665.97300310          0.03810841
        542.36718148          0.12331204
        194.57803492          0.29004471
         75.30359764          0.40587151
         29.57406259          0.20398411
  1  0  0  4  1
        191.20074660         -0.02441976
         58.84029988         -0.11547027
          8.96425408          0.56356637
          3.68569605          0.56709683
  1  0  0  2  1
          5.24642897         -0.22825334
          0.84862622          0.72625219
  1  0  0  1  1
          0.36743301          1.00000000
  1  0  0  1  1
          0.06682158          1.00000000
  1  0  0  1  1
          0.02675973          1.00000000
  1  1  1  6  1
        836.97262058          0.00252583
        197.93040142          0.02007651
         63.13555805          0.09130299
         23.28268717          0.25247030
          9.11764449          0.39426326
          3.63361201          0.23011559
  1  1  1  3  1
         13.49416312         -0.02649502
          1.81392598          0.55088108
          0.71981826          1.02806166
  1  1  1  1  1
          0.27629577          1.00000000
# SCANDIUM    (17s,10p,6d) -> [6s,3p,3d]
SC Ahlrichs-TZV
 12
  1  0  0  8  1
     191612.91874000          0.00023076
      28723.85036300          0.00178903
       6537.01164900          0.00929904
       1850.30971710          0.03773944
        602.38855156          0.12227148
        216.17324766          0.28814821
         83.71251788          0.40517543
         32.90870719          0.20566020
  1  0  0  4  1
        211.34393234         -0.02452799
         65.12892014         -0.11570158
         10.03431153          0.55995283
          4.15968846          0.56087765
  1  0  0  2  1
          6.00090416         -0.22840494
          0.98255784          0.71948970
  1  0  0  1  1
          0.42483193          1.00000000
  1  0  0  1  1
          0.07718546          1.00000000
  1  0  0  1  1
          0.03014722          1.00000000
  1  1  1  6  1
        947.34122823          0.00247372
        224.09699732          0.01974297
         71.56033488          0.09035715
         26.44482449          0.25201603
         10.39379829          0.39675536
          4.16063046          0.23208625
  1  1  1  3  1
         15.56573714         -0.02712942
          2.11215449          0.55109257
          0.84184709          1.00906358
  1  1  1  1  1
          0.32297543          1.00000000
  1  2  2  4  1
         30.98939099          0.01190284
          8.69054651          0.06765586
          2.95202563          0.21332540
          1.07619107          0.38391076
  1  2  2  1  1
          0.38338915          1.00000000
  1  2  2  1  1
          0.12534686          1.00000000
# TITANIUM    (17s,10p,6d) -> [6s,3p,3d]
TI Ahlrichs-TZV
 12
  1  0  0  8  1
     211575.69025000          0.00023318
      31714.94505800          0.00180797
       7217.54765430          0.00939843
       2042.93942470          0.03815685
        665.12896208          0.12374757
        238.74942264          0.29208551
         92.50869100          0.41226801
         36.40391921          0.21090534
  1  0  0  4  1
        232.72624607         -0.02492014
         71.79120971         -0.11746490
         11.15853462          0.56503342
          4.65481354          0.56211102
  1  0  0  2  1
          6.80346292         -0.23011426
          1.12010764          0.72103187
  1  0  0  1  1
          0.48080119          1.00000000
  1  0  0  1  1
          0.08515727          1.00000000
  1  0  0  1  1
          0.03265748          1.00000000
  1  1  1  6  1
       1063.14747320          0.00246908
        251.56507061          0.01977335
         80.40855485          0.09098798
         29.76819327          0.25559900
         11.73683056          0.40489387
          4.71423752          0.23693403
  1  1  1  3  1
         17.79680370         -0.02787864
          2.42726987          0.55672915
          0.96823446          1.00554473
  1  1  1  1  1
          0.37056694          1.00000000
  1  2  2  4  1
         37.71338472          0.01151384
         10.69293118          0.06724634
          3.67284470          0.21484208
          1.35885903          0.38890893
  1  2  2  1  1
          0.49213295          1.00000000
  1  2  2  1  1
          0.16330521          1.00000000
# VANADIUM    (17s,10p,6d) -> [6s,3p,3d]
V  Ahlrichs-TZV
 12
  1  0  0  8  1
     232340.65058000          0.00023072
      34828.84117000          0.00178882
       7926.54486910          0.00929925
       2243.77330460          0.03776146
        730.59322944          0.12255910
        262.32219631          0.28963509
        101.70403805          0.41004703
         40.06478462          0.21113611
  1  0  0  4  1
        255.24014968         -0.02445812
         78.80464696         -0.11527205
         12.34059895          0.55174749
          5.17420192          0.54504528
  1  0  0  2  1
          7.65138945         -0.22967638
          1.26397599          0.71683769
  1  0  0  1  1
          0.53861762          1.00000000
  1  0  0  1  1
          0.09271930          1.00000000
  1  0  0  1  1
          0.03499806          1.00000000
  1  1  1  6  1
       1184.23691510          0.00244498
        280.23075192          0.01964345
         89.64362714          0.09079695
         33.24241125          0.25650768
         13.14451445          0.40815394
          5.29485341          0.23860378
  1  1  1  3  1
         20.17558685         -0.02824149
          2.76058652          0.55574636
          1.10089009          0.99319919
  1  1  1  1  1
          0.42013311          1.00000000
  1  2  2  4  1
         43.86113486          0.01148717
         12.51602189          0.06824715
          4.33138550          0.21837784
          1.61388558          0.39245212
  1  2  2  1  1
          0.58749574          1.00000000
  1  2  2  1  1
          0.19515723          1.00000000
# CHROMIUM    (17s,10p,6d) -> [6s,3p,3d]
CR Ahlrichs-TZV
 12
  1  0  0  8  1
     254477.80704000          0.00023387
      38131.79705400          0.00181426
       8675.29306070          0.00943639
       2455.00998480          0.03834364
        799.16217787          0.12459195
        286.90021489          0.29489696
        111.25413232          0.41846150
         43.86415264          0.21633763
  1  0  0  4  1
        279.32669173         -0.02345091
         86.27473238         -0.11080370
         13.55575611          0.53028966
          5.69781128          0.51603517
  1  0  0  2  1
          8.56365826         -0.38109546
          1.39882968          1.19915914
  1  0  0  1  1
          0.57288171          1.00000000
  1  0  0  1  1
          0.09009617          1.00000000
  1  0  0  1  1
          0.03412589          1.00000000
  1  1  1  6  1
       1306.43988640          0.00242773
        309.25311441          0.01954404
         98.99627396          0.09065179
         36.75691645          0.25699279
         14.56665708          0.40935505
          5.87399374          0.23729389
  1  1  1  3  1
         22.89099970         -0.02816603
          3.08550018          0.56034120
          1.21323291          0.98119020
  1  1  1  1  1
          0.44931681          1.00000000
  1  2  2  4  1
         43.72007448          0.01362296
         12.39124265          0.07893518
          4.26394420          0.23833840
          1.55252218          0.39526851
  1  2  2  1  1
          0.53761929          1.00000000
  1  2  2  1  1
          0.16493173          1.00000000
# MANGANESE   (17s,10p,6d) -> [6s,3p,3d]
MN Ahlrichs-TZV
 12
  1  0  0  8  1
     277185.00153000          0.00022838
      41550.76989000          0.00177077
       9455.97001520          0.00920772
       2676.52064820          0.03741597
        871.46687530          0.12164861
        312.98306420          0.28824392
        121.44454051          0.41041601
         47.92259883          0.21372375
  1  0  0  4  1
        303.66723163         -0.02458993
         93.88140319         -0.11602608
         14.87942121          0.55112060
          6.28652007          0.53707561
  1  0  0  2  1
          9.48585913         -0.22889263
          1.56987062          0.71196170
  1  0  0  1  1
          0.65903214          1.00000000
  1  0  0  1  1
          0.10686292          1.00000000
  1  0  0  1  1
          0.03926744          1.00000000
  1  1  1  6  1
       1444.79781820          0.00239941
        342.06551197          0.01936929
        109.58400891          0.09023611
         40.74798817          0.25745468
         16.18862657          0.41272352
          6.54845060          0.24087700
  1  1  1  3  1
         25.35708644         -0.02870717
          3.48301688          0.55208101
          1.38588009          0.97226901
  1  1  1  1  1
          0.52555095          1.00000000
  1  2  2  4  1
         56.56318912          0.01154325
         16.27873471          0.07029985
          5.69642739          0.22450771
          2.14111479          0.39703065
  1  2  2  1  1
          0.78291802          1.00000000
  1  2  2  1  1
          0.25952311          1.00000000
# IRON        (17s,10p,6d) -> [6s,3p,3d]
FE Ahlrichs-TZV
 12
  1  0  0  8  1
     300784.84637000          0.00022806
      45088.97055700          0.00176818
      10262.51631700          0.00919271
       2905.28972930          0.03735550
        946.11487137          0.12151108
        339.87832894          0.28818881
        131.94425588          0.41126613
         52.11149408          0.21518584
  1  0  0  4  1
        329.48839267         -0.02474522
        101.92332739         -0.11683089
         16.24046274          0.55293621
          6.88406758          0.53601640
  1  0  0  2  1
         10.47069378         -0.22912709
          1.73600396          0.71159320
  1  0  0  1  1
          0.72577289          1.00000000
  1  0  0  1  1
          0.11595528          1.00000000
  1  0  0  1  1
          0.04196823          1.00000000
  1  1  1  6  1
       1585.39599700          0.00237940
        375.38006499          0.01925315
        120.31816501          0.09002184
         44.78874903          0.25798172
         17.82927858          0.41492650
          7.22471538          0.24207475
  1  1  1  3  1
         28.14321976         -0.02904176
          3.87432414          0.55312260
          1.54107523          0.96771137
  1  1  1  1  1
          0.58285615          1.00000000
  1  2  2  4  1
         61.99667503          0.01197197
         17.87373255          0.07321014
          6.27447829          0.23103094
          2.35523372          0.39910706
  1  2  2  1  1
          0.85432240          1.00000000
  1  2  2  1  1
          0.27869254          1.00000000
# COBALT      (17s,10p,6d) -> [6s,3p,3d]
CO Ahlrichs-TZV
 12
  1  0  0  8  1
     325817.01553000          0.00022568
      48839.63645300          0.00174994
      11114.93730700          0.00910031
       3146.16036420          0.03699626
       1024.43784650          0.12044270
        368.02508816          0.28598732
        142.91229205          0.40908312
         56.48264921          0.21500146
  1  0  0  4  1
        356.40298318         -0.02476706
        110.31165215         -0.11702139
         17.65963483          0.55215522
          7.50590305          0.53246877
  1  0  0  2  1
         11.50180718         -0.22942470
          1.90819946          0.71180934
  1  0  0  1  1
          0.79396697          1.00000000
  1  0  0  1  1
          0.12444449          1.00000000
  1  0  0  1  1
          0.04444465          1.00000000
  1  1  1  6  1
       1731.13691440          0.00239058
        409.91750438          0.01938300
        131.45648578          0.09090545
         48.98743971          0.26146682
         19.53707899          0.42157265
          7.92872816          0.24571814
  1  1  1  3  1
         31.07601758         -0.02943807
          4.28351807          0.55615568
          1.70229216          0.96772195
  1  1  1  1  1
          0.64202909          1.00000000
  1  2  2  4  1
         68.14074524          0.01198385
         19.68524102          0.07368854
          6.93221288          0.23085497
          2.60251257          0.39281059
  1  2  2  1  1
          0.94016837          0.49652611
  1  2  2  1  1
          0.30381458          0.32719933
# NICKEL      (17s,10p,6d) -> [6s,3p,3d]
NI Ahlrichs-TZV
 12
  1  0  0  8  1
     351535.72935000          0.00022529
      52695.80928300          0.00174686
      11992.46829300          0.00908500
       3394.57766890          0.03694075
       1105.35945850          0.12032820
        397.14677769          0.28596715
        154.27542974          0.40983020
         61.01872378          0.21620643
  1  0  0  4  1
        384.45559739         -0.02465128
        119.04879199         -0.11658505
         19.13701222          0.54864127
          8.15267186          0.52640051
  1  0  0  2  1
         12.57940864         -0.22797884
          2.08708661          0.70703738
  1  0  0  1  1
          0.86432569          1.00000000
  1  0  0  1  1
          0.13283169          1.00000000
  1  0  0  1  1
          0.04684533          1.00000000
  1  1  1  6  1
       1883.09074860          0.00237483
        445.95155320          0.01928946
        143.08430815          0.09071821
         53.37292072          0.26181414
         21.32191936          0.42309150
          8.66435620          0.24641686
  1  1  1  3  1
         34.14425521         -0.02967713
          4.71224559          0.55616824
          1.87092318          0.96357766
  1  1  1  1  1
          0.70370016          1.00000000
  1  2  2  4  1
         74.59160347          0.01207745
         21.59063275          0.07463726
          7.62461426          0.23236776
          2.86322068          0.39042652
  1  2  2  1  1
          1.03110634          0.51501528
  1  2  2  1  1
          0.33060761          0.33962671
# COPPER      (17s,10p,6d) -> [6s,3p,3d]
CU Ahlrichs-TZV
 12
  1  0  0  8  1
     377518.79923000          0.00022812
      56589.98431100          0.00176880
      12878.71170600          0.00919935
       3645.37521430          0.03741102
       1187.00729450          0.12189874
        426.46421902          0.28983901
        165.70660164          0.41531872
         65.59894271          0.21905799
  1  0  0  4  1
        414.41265811         -0.02468253
        128.32056039         -0.11716827
         20.62208975          0.55301316
          8.78212260          0.52242719
  1  0  0  2  1
         13.74137201         -0.22736062
          2.24312468          0.71761211
  1  0  0  1  1
          0.89370549          1.00000000
  1  0  0  1  1
          0.10836700          1.00000000
  1  0  0  1  1
          0.03880618          1.00000000
  1  1  1  6  1
       2034.75966920          0.00235248
        481.90468106          0.01913407
        154.67482963          0.09017111
         57.74057697          0.26063285
         23.09905281          0.42093486
          9.38824786          0.24344615
  1  1  1  3  1
         37.59617121         -0.02899109
          5.12406908          0.54919084
          2.01199961          0.93793330
  1  1  1  1  1
          0.73860686          1.00000000
  1  2  2  4  1
         74.12946064          0.01436322
         21.35984259          0.08662818
          7.49952405          0.25631431
          2.76013942          0.40374062
  1  2  2  1  1
          0.95362061          1.00000000
  1  2  2  1  1
          0.28420863          1.00000000
# ZINC        (17s,10p,6d) -> [6s,3p,3d]
ZN Ahlrichs-TZV
 12
  1  0  0  8  1
     405924.31028000          0.00022442
      60846.95573500          0.00174021
      13847.34309200          0.00905133
       3919.61585510          0.03681734
       1276.35941670          0.12004850
        458.67254435          0.28576058
        178.28725246          0.41087462
         70.61219284          0.21816962
  1  0  0  4  1
        443.88077950         -0.02493427
        137.55875267         -0.11817956
         22.26808348          0.55367318
          9.52173106          0.52628935
  1  0  0  2  1
         14.87411407         -0.22929955
          2.46475176          0.71135485
  1  0  0  1  1
          1.01132722          1.00000000
  1  0  0  1  1
          0.14919852          1.00000000
  1  0  0  1  1
          0.05144187          1.00000000
  1  1  1  6  1
       2205.35085340          0.00233562
        522.35300699          0.01903102
        167.73055542          0.08995576
         62.67004537          0.26113249
         25.10974946          0.42348448
         10.22514268          0.24618927
  1  1  1  3  1
         40.71344252         -0.03002967
          5.62470907          0.55575255
          2.22799491          0.95581013
  1  1  1  1  1
          0.83354742          1.00000000
  1  2  2  4  1
         88.55431531          0.01272817
         25.72152556          0.07939450
          9.12783676          0.24491507
          3.43123641          0.40390526
  1  2  2  1  1
          1.23089206          1.00000000
  1  2  2  1  1
          0.39031845          1.00000000
# GALLIUM     (17s,12p,6p) -> [6s,5p,2d]
GA Ahlrichs-TZV
 13
  1  0  0  8  1
     435548.66254000          0.00023646
      65289.58903100          0.00183353
      14858.78425600          0.00953719
       4205.97347290          0.03880341
       1369.64164310          0.12661605
        492.30348905          0.30175310
        191.41923233          0.43543934
         75.84055867          0.23282364
  1  0  0  4  1
        474.30810613         -0.02674371
        147.10297560         -0.12654658
         23.98259943          0.58840347
         10.29823009          0.56324272
  1  0  0  2  1
         16.05038143         -0.24516440
          2.69884688          0.74578050
  1  0  0  1  1
          1.14285887          1.00000000
  1  0  0  1  1
          0.20217652          1.00000000
  1  0  0  1  1
          0.07198015          1.00000000
  1  1  1  6  1
       2432.01710700          0.00224341
        576.12049582          0.01834227
        185.11584354          0.08727970
         69.24657256          0.25684868
         27.81810778          0.42398378
         11.42022994          0.25701340
  1  1  1  3  1
         42.81966153         -0.01932652
          6.38859010          0.31571387
          2.66989933          0.57617793
  1  1  1  1  1
          1.07817838          1.00000000
  1  1  1  1  1
          0.22796559          1.00000000
  1  1  1  1  1
          0.06283623          1.00000000
  1  2  2  5  1
        103.92331829          0.01146461
         30.37109439          0.07362575
         10.87207810          0.23505107
          4.15491380          0.40318564
          1.53456591          0.40824748
  1  2  2  1  1
          0.51114264          1.00000000
# GERMANIUM   (17s,12p,6p) -> [6s,5p,2d]
GE Ahlrichs-TZV
 13
  1  0  0  8  1
     466115.00592000          0.00022487
      69875.42076200          0.00174354
      15903.27671600          0.00906915
       4501.82334530          0.03690617
       1466.05709240          0.12050168
        527.07841728          0.28748642
        205.00395074          0.41622322
         81.25159607          0.22397846
  1  0  0  4  1
        505.74661282         -0.02518461
        156.96593744         -0.11898930
         25.76144818          0.54930136
         11.10665469          0.52939309
  1  0  0  2  1
         17.27205910         -0.22854596
          2.94382890          0.68377930
  1  0  0  1  1
          1.28391649          1.00000000
  1  0  0  1  1
          0.25873337          1.00000000
  1  0  0  1  1
          0.09352491          1.00000000
  1  1  1  6  1
       2633.93462410          0.00221439
        624.00161628          0.01814090
        200.58528404          0.08663218
         75.09708153          0.25649021
         30.21438847          0.42658611
         12.44008757          0.26200527
  1  1  1  3  1
         45.98131600         -0.02032177
          6.99456544          0.32013745
          2.96860013          0.59051015
  1  1  1  1  1
          1.23209885          1.00000000
  1  1  1  1  1
          0.28981615          1.00000000
  1  1  1  1  1
          0.08556461          1.00000000
  1  2  2  5  1
        119.44887581          0.01058654
         35.06291529          0.06960128
         12.63692453          0.22807035
          4.88886729          0.40301067
          1.84531954          0.41304847
  1  2  2  1  1
          0.63571159          1.00000000
# ARSENIC     (17s,13p,6p) -> [6s,5p,2d]
AS Ahlrichs-TZV
 13
  1  0  0  8  1
     498032.42158000          0.00022740
      74656.86874300          0.00176328
      16990.96000400          0.00917280
       4809.62003210          0.03733783
       1566.28870550          0.12199536
        563.21360499          0.29137475
        219.11179978          0.42326351
         86.86606103          0.22921464
  1  0  0  4  1
        538.19512479         -0.02525420
        167.14850224         -0.11915461
         27.60551716          0.54628496
         11.94785852          0.53001521
  1  0  0  2  1
         18.53802313         -0.23479188
          3.20189857          0.69167053
  1  0  0  1  1
          1.43565221          1.00000000
  1  0  0  1  1
          0.31837805          1.00000000
  1  0  0  1  1
          0.11622632          1.00000000
  1  1  1  6  1
       2678.94215460          0.00233190
        634.61765840          0.01904215
        203.93967606          0.09022974
         76.32389037          0.26169038
         30.66412494          0.41857168
         12.50505673          0.23447830
  1  1  1  4  1
         49.25622955         -0.02123554
          7.72748915          0.30470207
          3.54104935          0.52888373
          1.69855855          0.37272251
  1  1  1  1  1
          0.76848071          1.00000000
  1  1  1  1  1
          0.30050823         -0.35023592
  1  1  1  1  1
          0.09819064          1.00000000
  1  2  2  5  1
        135.33289305          0.00992911
         39.86021274          0.06656884
         14.44642836          0.22275768
          5.64329004          0.40309224
          2.16681886          0.41671668
  1  2  2  1  1
          0.76514971          1.00000000
# SELENIUM    (17s,13p,6p) -> [6s,5p,2d]
SE Ahlrichs-TZV
 13
  1  0  0  8  1
     531071.66696000          0.00024109
      79603.04411700          0.00186964
      18115.84424000          0.00972716
       5127.89231940          0.03960479
       1669.91308390          0.12948855
        600.57534527          0.30959437
        233.70021247          0.45115769
         92.67244393          0.24579189
  1  0  0  4  1
        571.57513675         -0.02689571
        177.63686375         -0.12670989
         29.51776705          0.57699002
         12.82439979          0.56369075
  1  0  0  2  1
         19.84823584         -0.25132416
          3.47440185          0.72905417
  1  0  0  1  1
          1.59889108          1.00000000
  1  0  0  1  1
          0.38333469          1.00000000
  1  0  0  1  1
          0.14049742          1.00000000
  1  1  1  6  1
       2815.35005660          0.00255690
        666.92558298          0.02087403
        214.34213188          0.09877210
         80.24668794          0.28471821
         32.25108129          0.45003585
         13.10643256          0.24416091
  1  1  1  4  1
         53.36610852         -0.02155846
          8.18277772          0.32662311
          3.62399457          0.57740499
          1.63415914          0.34301321
  1  1  1  1  1
          0.58418320          1.00000000
  1  1  1  1  1
          0.23966269          1.00000000
  1  1  1  1  1
          0.08878513          1.00000000
  1  2  2  5  1
        151.82910279          0.00939703
         44.83999252          0.06408650
         16.32899951          0.21834238
          6.43050576          0.40314790
          2.50480252          0.41966491
  1  2  2  1  1
          0.90271148          1.00000000
# BROMINE     (17s,13p,6p) -> [6s,5p,2d]
BR Ahlrichs-TZV
 13
  1  0  0  8  1
     565073.25256000          0.00023660
      84701.72317900          0.00183483
      19276.27190000          0.00954658
       5456.42845760          0.03887714
       1776.95035000          0.12718314
        639.19398276          0.30437662
        248.78823961          0.44490940
         98.67830549          0.24381643
  1  0  0  4  1
        606.07824568         -0.02652716
        188.45598484         -0.12484585
         31.49714451          0.56468684
         13.73600832          0.55555269
  1  0  0  2  1
         21.20321277         -0.24940920
          3.76164202          0.71213120
  1  0  0  1  1
          1.77359340          1.00000000
  1  0  0  1  1
          0.45197414          1.00000000
  1  0  0  1  1
          0.16613377          1.00000000
  1  1  1  6  1
       3019.69557230          0.00249710
        715.35481126          0.02041927
        229.98328751          0.09689715
         86.16784462          0.28053901
         34.66787080          0.44606390
         14.11387031          0.24410074
  1  1  1  4  1
         57.08565308         -0.02185595
          8.81938458          0.32707075
          3.93403029          0.57855230
          1.79988304          0.33570988
  1  1  1  1  1
          0.66899411          1.00000000
  1  1  1  1  1
          0.27136238          1.00000000
  1  1  1  1  1
          0.10083790          1.00000000
  1  2  2  5  1
        168.85370257          0.00896640
         49.97794992          0.06206206
         18.27491334          0.21474732
          7.24556946          0.40335337
          2.85623150          0.42208813
  1  2  2  1  1
          1.04596211          1.00000000
# KRYPTON     (17s,13p,6p) -> [6s,5p,2d]
KR Ahlrichs-TZV
 13
  1  0  0  8  1
     600250.97575000          0.00023741
      89976.65078100          0.00184102
      20476.81422500          0.00957956
       5796.15540780          0.03902065
       1887.59131960          0.12772646
        679.11458519          0.30596521
        264.38244511          0.44857474
        104.88368574          0.24722957
  1  0  0  4  1
        641.47370764         -0.02674528
        199.57524820         -0.12571123
         33.54546295          0.56483736
         14.68395514          0.55972766
  1  0  0  2  1
         22.60310186         -0.25298772
          4.06506830          0.70992160
  1  0  0  1  1
          1.96110271          1.00000000
  1  0  0  1  1
          0.52465148          1.00000000
  1  0  0  1  1
          0.19332400          1.00000000
  1  1  1  6  1
       3232.95896140          0.00248856
        765.96442694          0.02037901
        246.33940810          0.09697719
         92.36528304          0.28199961
         37.19950955          0.45116254
         15.17216653          0.24917131
  1  1  1  4  1
         60.93132170         -0.02217360
          9.47926006          0.32838463
          4.25646863          0.58124997
          1.97293138          0.32863542
  1  1  1  1  1
          0.76337109          1.00000000
  1  1  1  1  1
          0.30943626          0.55671931
  1  1  1  1  1
          0.11569704          1.00000000
  1  2  2  5  1
        186.41760904          0.00861203
         55.27412435          0.06039441
         20.28321912          0.21181332
          8.08845370          0.40366293
          3.22140339          0.42402861
  1  2  2  1  1
          1.19521701          1.00000000
# BASIS="Ahlrichs pTZV"
# this basis has been constructed adding Ahlrichs polarization to Ahlrichs TZV
#Elements                             References
#--------                             ----------
#Li - Kr: A. Schafer, C. Huber and R. Ahlrichs, J. Chem. Phys. 100, 5829 (1994).
#H,He from VTZ
# HYDROGEN    (5s) -> [3s]
# HYDROGEN    (1p)
H  Ahlrichs-pTZV
  4
  1  0  0  3  1
         34.06134100          0.00602520
          5.12357460          0.04502109
          1.16466260          0.20189726
  1  0  0  1  1
          0.32723041          1.00000000
  1  0  0  1  1
          0.10307241          1.00000000
  1  1  1  1  1
          0.80000000          1.00000000
# HELIUM      (5s) -> [3s]
# HELIUM      (1p)
HE Ahlrichs-pTZV
  4
  1  0  0  3  1
         98.07832162          0.00758031
         14.76440425          0.05484862
          3.31858315          0.22074382
  1  0  0  1  1
          0.87413870          1.00000000
  1  0  0  1  1
          0.24459897          1.00000000
  1  1  1  1  1
          1.00000000          1.00000000
# LITHIUM     (11s) -> [5s]
# LITHIUM     (1p)
LI Ahlrichs-pTZV
  6
  1  0  0  6  1
       6269.26280100          0.00020541
        940.31612431          0.00159166
        214.22107528          0.00828698
         60.75984018          0.03385637
         19.91515203          0.11103226
          7.31715098          0.27449383
  1  0  0  2  1
          2.97246742          0.23792456
          1.26398523          0.30765412
  1  0  0  1  1
          0.51427490          1.00000000
  1  0  0  1  1
          0.07703089          1.00000000
  1  0  0  1  1
          0.02893890          1.00000000
  1  1  1  1  1
          0.17000000          1.00000000
# BERYLLIUM   (11s) -> [5s]
# BERYLLIUM   (2p)
BE Ahlrichs-pTZV
  7
  1  0  0  6  1
       4700.23656260          0.00023584
        704.82845622          0.00182438
        160.43110478          0.00939661
         45.42534734          0.03690892
         14.79833412          0.10897561
          5.35124525          0.21694285
  1  0  0  2  1
          2.15420448          0.44695409
          0.93363744          0.20866986
  1  0  0  1  1
          0.18791433          1.00000000
  1  0  0  1  1
          0.74648268          1.00000000
  1  0  0  1  1
          0.03265048          1.00000000
  1  1  1  3  1
          3.63169171         -0.02903400
          0.71695694         -0.16877854
          0.19541933         -0.51403420
  1  1  1  1  1
          0.06051547          1.00000000
# BORON       (11s,6p) -> [5s,3p]
# BORON       (1d)
B  Ahlrichs-pTZV
  9
  1  0  0  6  1
       8564.86606870          0.00022837
       1284.15162630          0.00176826
        292.27871604          0.00914071
         82.77546918          0.03634264
         27.01793927          0.11063458
          9.81496197          0.23367344
  1  0  0  2  1
          3.93185591          0.41818778
          1.65955997          0.22325474
  1  0  0  1  1
          0.35762965          1.00000000
  1  0  0  1  1
          0.14246277          1.00000000
  1  0  0  1  1
          0.06056059          1.00000000
  1  1  1  4  1
         22.45387580          0.00502656
          5.10450583          0.03280174
          1.49860813          0.13151231
          0.50927831          0.33197168
  1  1  1  1  1
          0.18147078          1.00000000
  1  1  1  1  1
          0.06462189          1.00000000
  1  2  2  1  1
          0.50000000          1.00000000
# CARBON      (11s,6p) -> [5s,3p]
# CARBON      (1d)
C  Ahlrichs-pTZV
  9
  1  0  0  6  1
      13575.34968200          0.00022246
       2035.23336800          0.00172327
        463.22562359          0.00892557
        131.20019598          0.03572798
         42.85301589          0.11076260
         15.58418577          0.24295628
  1  0  0  2  1
          6.20671385          0.41440263
          2.57648965          0.23744969
  1  0  0  1  1
          0.57696339          1.00000000
  1  0  0  1  1
          0.22972831          1.00000000
  1  0  0  1  1
          0.09516444          1.00000000
  1  1  1  4  1
         34.69723224          0.00533337
          7.95826228          0.03586411
          2.37808269          0.14215873
          0.81433208          0.34270472
  1  1  1  1  1
          0.28887547          1.00000000
  1  1  1  1  1
          0.10056824          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
# NITROGEN    (11s,6p) -> [5s,3p]
# NITROGEN    (1d)
N  Ahlrichs-pTZV
  9
  1  0  0  6  1
      19730.80064700          0.00021888
       2957.89587450          0.00169607
        673.22133595          0.00879546
        190.68249494          0.03535938
         62.29544190          0.11095789
         22.65416118          0.24982973
  1  0  0  2  1
          8.97914774          0.40623896
          3.68630024          0.24338217
  1  0  0  1  1
          0.84660077          1.00000000
  1  0  0  1  1
          0.33647134          1.00000000
  1  0  0  1  1
          0.13647654          1.00000000
  1  1  1  4  1
         49.20038051          0.00555524
         11.34679054          0.03805238
          3.42739724          0.14953671
          1.17855251          0.34949305
  1  1  1  1  1
          0.41642205          1.00000000
  1  1  1  1  1
          0.14260826          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# OXYGEN      (11s,6p) -> [5s,3p]
# OXYGEN      (1d)
O  Ahlrichs-pTZV
  9
  1  0  0  6  1
      27032.38263100          0.00021726
       4052.38713920          0.00168387
        922.32722710          0.00873956
        261.24070989          0.03523997
         85.35464135          0.11153519
         31.03503524          0.25588954
  1  0  0  2  1
         12.26086073          0.39768731
          4.99870760          0.24627849
  1  0  0  1  1
          1.17031082          1.00000000
  1  0  0  1  1
          0.46474741          1.00000000
  1  0  0  1  1
          0.18504536          1.00000000
  1  1  1  4  1
         63.27495480          0.00606851
         14.62704938          0.04191258
          4.45012235          0.16153841
          1.52757996          0.35706951
  1  1  1  1  1
          0.52935118          1.00000000
  1  1  1  1  1
          0.17478421          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# FLUORINE    (11s,6p) -> [5s,3p]
# FLUORINE    (1d)
F  Ahlrichs-pTZV
  9
  1  0  0  6  1
      35479.10044100          0.00021545
       5318.47289830          0.00167007
       1210.48109750          0.00867332
        342.85518140          0.03504993
        112.01943181          0.11165320
         40.71474025          0.25988507
  1  0  0  2  1
         16.03967811          0.39422967
          6.50381867          0.24998239
  1  0  0  1  1
          1.54404775          1.00000000
  1  0  0  1  1
          0.61223453          1.00000000
  1  0  0  1  1
          0.24027980          1.00000000
  1  1  1  4  1
         80.23390048          0.00636860
         18.59401074          0.04430314
          5.68679027          0.16867249
          1.95110063          0.36166346
  1  1  1  1  1
          0.66970211          1.00000000
  1  1  1  1  1
          0.21651300          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# NEON        (11s,6p) -> [5s,3p]
# NEON        (1d)
NE Ahlrichs-pTZV
  9
  1  0  0  6  1
      45069.46402200          0.00021687
       6755.97686560          0.00168127
       1537.65028640          0.00873561
        435.51697667          0.03536127
        142.28655638          0.11321521
         51.69215380          0.26654653
  1  0  0  2  1
         20.31587049          0.39631960
          8.20219426          0.25582811
  1  0  0  1  1
          1.96812763          1.00000000
  1  0  0  1  1
          0.77904756          1.00000000
  1  0  0  1  1
          0.30229502          1.00000000
  1  1  1  4  1
         99.78299603          0.00655692
         23.17612410          0.04588801
          7.11639459          0.17331288
          2.44187114          0.36475268
  1  1  1  1  1
          0.83389606          1.00000000
  1  1  1  1  1
          0.26607311          1.00000000
  1  2  2  1  1
          1.88800000          1.00000000
# SODIUM      (14s,6p) -> [5s,2p]
# SODIUM      (1p)
NA Ahlrichs-pTZV
  8
  1  0  0  7  1
      26041.10992700          0.00061806
       3906.12685480          0.00477486
        888.97454993          0.02447168
        251.45497961          0.09475539
         81.65014351          0.26867497
         28.90415840          0.47925475
         10.62578293          0.33248591
  1  0  0  3  1
         53.76941018          0.01952773
         16.30824302          0.09264801
          2.37303841         -0.39938670
  1  0  0  2  1
          0.95730773          1.64285954
          0.40806461          0.55692597
  1  0  0  1  1
          0.04996758          1.00000000
  1  0  0  1  1
          0.01926862          1.00000000
  1  1  1  5  1
        138.07979989          0.00579519
         32.23270039          0.04162085
          9.98160754          0.16281917
          3.48220339          0.36011785
          1.22991346          0.44858980
  1  1  1  1  1
          0.41743959          1.00000000
  1  1  1  1  1
          0.05200000          1.00000000
# MAGNESIUM   (14s,6p) -> [5s,2p]
# MAGNESIUM   (1p)
MG Ahlrichs-pTZV
  8
  1  0  0  7  1
      31438.34955500          0.00060912
       4715.51533540          0.00470662
       1073.16292470          0.02413582
        303.57238768          0.09362896
         98.62625104          0.26646742
         34.94380842          0.47890930
         12.85978520          0.33698490
  1  0  0  3  1
         64.87691300          0.01918089
         19.72552078          0.09091370
          2.89518043         -0.39563756
  1  0  0  2  1
          1.19604547          1.68276034
          0.54329451          0.52141092
  1  0  0  1  1
          0.10099104          1.00000000
  1  0  0  1  1
          0.03686573          1.00000000
  1  1  1  5  1
        179.87189612          0.00537995
         42.12006938          0.03931801
         13.12050303          0.15740129
          4.62575036          0.35919094
          1.66952110          0.45533379
  1  1  1  1  1
          0.58551012          1.00000000
  1  1  1  1  1
          0.18914796          1.00000000
# ALUMINUM    (14s,9p) -> [5s,4p]
# ALUMINUM    (1d)
AL Ahlrichs-pTZV
 10
  1  0  0  7  1
      37792.55077200          0.00057048
       5668.06821650          0.00440930
       1289.85828410          0.02263097
        364.86596028          0.08802564
        118.57631515          0.25223702
         42.02486760          0.45960547
         15.49950163          0.33277886
  1  0  0  3  1
         75.20802660          0.01925056
         23.03140897          0.08790674
          3.63487976         -0.34246705
  1  0  0  2  1
          1.60650500          1.51062661
          0.76103395          0.58071016
  1  0  0  1  1
          0.16556709          1.00000000
  1  0  0  1  1
          0.06004158          1.00000000
  1  1  1  6  1
        452.52303192          0.00231108
        107.08195049          0.01856864
         34.13102125          0.08721624
         12.58703743          0.26902102
          4.98119197          0.52128324
          2.00703509          0.60271687
  1  1  1  1  1
          0.80083714          1.00000000
  1  1  1  1  1
          0.20178927          1.00000000
  1  1  1  1  1
          0.05789555          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
# SILICON     (14s,9p) -> [5s,4p]
# SILICON     (1d)
SI Ahlrichs-pTZV
 10
  1  0  0  7  1
      44773.35807800          0.00055915
       6717.19921040          0.00432060
       1528.89603250          0.02218710
        432.54746585          0.08648925
        140.61505226          0.24939890
         49.85763672          0.46017197
         18.43497489          0.34250237
  1  0  0  3  1
         86.53388611          0.02130006
         26.62460685          0.09467614
          4.49530572         -0.32616265
  1  0  0  2  1
          2.10350457          1.39808039
          1.01060949          0.63865787
  1  0  0  1  1
          0.23701751          1.00000000
  1  0  0  1  1
          0.08570341          1.00000000
  1  1  1  6  1
        394.47503628          0.00262857
         93.13768310          0.02055626
         29.51960874          0.09207026
         10.78166379          0.25565890
          4.16265748          0.42111707
          1.62479730          0.34401746
  1  1  1  1  1
          0.54306660          1.00000000
  1  1  1  1  1
          0.20582074          1.00000000
  1  1  1  1  1
          0.07005349          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
# PHOSPHORUS  (14s,9p) -> [5s,4p]
# PHOSPHORUS  (1d)
P  Ahlrichs-pTZV
 10
  1  0  0  7  1
      52426.99923300          0.00055207
       7863.26605520          0.00426786
       1789.52273330          0.02193153
        506.27300165          0.08566717
        164.60698546          0.24840687
         58.39191872          0.46336754
         21.64366320          0.35350558
  1  0  0  3  1
         99.01383762          0.02189568
         30.55043982          0.09565047
          5.45370877         -0.29454270
  1  0  0  2  1
          2.65033626          1.32943812
          1.27266889          0.66109396
  1  0  0  1  1
          0.31645005          1.00000000
  1  0  0  1  1
          0.11417467          1.00000000
  1  1  1  6  1
        472.27219248          0.00257106
        111.58882756          0.02025030
         35.44593642          0.09158072
         12.99077688          0.25749454
          5.04862217          0.42862900
          1.99340496          0.34359818
  1  1  1  1  1
          0.66527284          1.00000000
  1  1  1  1  1
          0.25516832          1.00000000
  1  1  1  1  1
          0.09035776          1.00000000
  1  2  2  1  1
          0.45000000          1.00000000
# SULFUR      (14s,9p) -> [5s,4p]
# SULFUR      (1d)
S  Ahlrichs-pTZV
 10
  1  0  0  7  1
      60700.92810400          0.00054696
       9102.61068540          0.00422972
       2071.41660090          0.02174782
        586.02476821          0.08510005
        190.55395021          0.24799128
         67.63038426          0.46703640
         25.12730691          0.36434588
  1  0  0  3  1
        112.57463010          0.02167004
         34.79555422          0.09360230
          6.51155562         -0.26068001
  1  0  0  2  1
          3.23990323          1.28420894
          1.54771609          0.66036417
  1  0  0  1  1
          0.40541030          1.00000000
  1  0  0  1  1
          0.14550651          1.00000000
  1  1  1  6  1
        564.36716027          0.00247968
        133.42624379          0.01967793
         42.46827119          0.08998001
         15.61652758          0.25705881
          6.10939885          0.43515167
          2.44041602          0.34883241
  1  1  1  1  1
          0.83882201          1.00000000
  1  1  1  1  1
          0.31288747          1.00000000
  1  1  1  1  1
          0.10770109          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
# CHLORINE    (14s,9p) -> [5s,4p]
# CHLORINE    (1d)
CL Ahlrichs-pTZV
 10
  1  0  0  7  1
      69507.99094500          0.00054315
      10426.15688000          0.00419905
       2373.23340610          0.02159214
        671.56420071          0.08459885
        218.41999790          0.24757250
         77.57224971          0.47016930
         28.88881528          0.37436371
  1  0  0  3  1
        127.10527185          0.02518217
         39.33958296          0.10786112
          7.67406800         -0.27408822
  1  0  0  2  1
          3.87456276          1.32138750
          1.83858326          0.68636955
  1  0  0  1  1
          0.50229058          1.00000000
  1  0  0  1  1
          0.17962723          1.00000000
  1  1  1  6  1
        666.50423284          0.00236327
        157.64241690          0.01887930
         50.26252098          0.08720634
         18.53607811          0.25285613
          7.29405328          0.43507155
          2.94332490          0.35026513
  1  1  1  1  1
          1.04049708          1.00000000
  1  1  1  1  1
          0.38456415          1.00000000
  1  1  1  1  1
          0.13069643          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
# ARGON       (14s,9p) -> [5s,4p]
# ARGON       (1d)
AR Ahlrichs-pTZV
 10
  1  0  0  7  1
      79111.42299800          0.00051029
      11864.74600900          0.00394630
       2700.16429730          0.02030707
        763.95943485          0.07969183
        248.45150561          0.23420624
         88.28358100          0.44833849
         32.94860707          0.36408167
  1  0  0  3  1
        142.55358000          0.02638741
         44.16368801          0.11226434
          8.95249950         -0.26178922
  1  0  0  2  1
          4.55469209          1.30024850
          2.14440790          0.67197237
  1  0  0  1  1
          0.60708777          1.00000000
  1  0  0  1  1
          0.21651432          1.00000000
  1  1  1  6  1
        776.77541998          0.00220280
        183.80107018          0.01769418
         58.69400317          0.08243129
         21.70159170          0.24207279
          8.58214896          0.42263558
          3.49226792          0.34151806
  1  1  1  1  1
          1.26374270          1.00000000
  1  1  1  1  1
          0.46607870          1.00000000
  1  1  1  1  1
          0.15766003          1.00000000
  1  2  2  1  1
          0.96900000          1.00000000
# POTASSIUM   (17s,10p) -> [6s,3p]
# POTASSIUM   (1p)
K  Ahlrichs-pTZV
 10
  1  0  0  8  1
     153976.18325000          0.00023663
      23082.49767200          0.00183429
       5253.23447450          0.00953105
       1486.95501330          0.03863841
        484.06333726          0.12480769
        173.56653980          0.29278861
         67.11638146          0.40633426
         26.33950205          0.20077216
  1  0  0  4  1
        172.87693567         -0.02420096
         53.05864906         -0.11553095
          7.92127540          0.57455545
          3.21088805          0.57023185
  1  0  0  2  1
          4.56620709         -0.22615763
          0.70209907          0.75528392
  1  0  0  1  1
          0.28258943          1.00000000
  1  0  0  1  1
          0.03580582          1.00000000
  1  0  0  1  1
          0.01581921          1.00000000
  1  1  1  6  1
        728.18449873          0.00261507
        172.13265061          0.02067363
         54.82984707          0.09320560
         20.16626649          0.25436518
          7.86107288          0.39131133
          3.11052131          0.22481346
  1  1  1  3  1
         11.75733749         -0.02577729
          1.51396174          0.57359429
          0.58328592          1.07983200
  1  1  1  1  1
          0.21570478          1.00000000
  1  1  1  1  1
          0.04173700          1.00000000
# CALCIUM     (17s,10p) -> [6s,3p]
# CALCIUM     (1p)
CA Ahlrichs-pTZV
 10
  1  0  0  8  1
     172517.32685000          0.00023318
      25861.51927500          0.00180765
       5885.66186680          0.00939438
       1665.97300310          0.03810841
        542.36718148          0.12331204
        194.57803492          0.29004471
         75.30359764          0.40587151
         29.57406259          0.20398411
  1  0  0  4  1
        191.20074660         -0.02441976
         58.84029988         -0.11547027
          8.96425408          0.56356637
          3.68569605          0.56709683
  1  0  0  2  1
          5.24642897         -0.22825334
          0.84862622          0.72625219
  1  0  0  1  1
          0.36743301          1.00000000
  1  0  0  1  1
          0.06682158          1.00000000
  1  0  0  1  1
          0.02675973          1.00000000
  1  1  1  6  1
        836.97262058          0.00252583
        197.93040142          0.02007651
         63.13555805          0.09130299
         23.28268717          0.25247030
          9.11764449          0.39426326
          3.63361201          0.23011559
  1  1  1  3  1
         13.49416312         -0.02649502
          1.81392598          0.55088108
          0.71981826          1.02806166
  1  1  1  1  1
          0.27629577          1.00000000
  1  1  1  1  1
          0.07497900          1.00000000
# SCANDIUM    (17s,10p,6d) -> [6s,3p,3d]
# SCANDIUM    (1p)
SC Ahlrichs-pTZV
 13
  1  0  0  8  1
     191612.91874000          0.00023076
      28723.85036300          0.00178903
       6537.01164900          0.00929904
       1850.30971710          0.03773944
        602.38855156          0.12227148
        216.17324766          0.28814821
         83.71251788          0.40517543
         32.90870719          0.20566020
  1  0  0  4  1
        211.34393234         -0.02452799
         65.12892014         -0.11570158
         10.03431153          0.55995283
          4.15968846          0.56087765
  1  0  0  2  1
          6.00090416         -0.22840494
          0.98255784          0.71948970
  1  0  0  1  1
          0.42483193          1.00000000
  1  0  0  1  1
          0.07718546          1.00000000
  1  0  0  1  1
          0.03014722          1.00000000
  1  1  1  6  1
        947.34122823          0.00247372
        224.09699732          0.01974297
         71.56033488          0.09035715
         26.44482449          0.25201603
         10.39379829          0.39675536
          4.16063046          0.23208625
  1  1  1  3  1
         15.56573714         -0.02712942
          2.11215449          0.55109257
          0.84184709          1.00906358
  1  1  1  1  1
          0.32297543          1.00000000
  1  2  2  4  1
         30.98939099          0.01190284
          8.69054651          0.06765586
          2.95202563          0.21332540
          1.07619107          0.38391076
  1  2  2  1  1
          0.38338915          1.00000000
  1  2  2  1  1
          0.12534686          1.00000000
  1  1  1  1  1
          0.08974800          1.00000000
# TITANIUM    (17s,10p,6d) -> [6s,3p,3d]
# TITANIUM    (1p)
TI Ahlrichs-pTZV
 13
  1  0  0  8  1
     211575.69025000          0.00023318
      31714.94505800          0.00180797
       7217.54765430          0.00939843
       2042.93942470          0.03815685
        665.12896208          0.12374757
        238.74942264          0.29208551
         92.50869100          0.41226801
         36.40391921          0.21090534
  1  0  0  4  1
        232.72624607         -0.02492014
         71.79120971         -0.11746490
         11.15853462          0.56503342
          4.65481354          0.56211102
  1  0  0  2  1
          6.80346292         -0.23011426
          1.12010764          0.72103187
  1  0  0  1  1
          0.48080119          1.00000000
  1  0  0  1  1
          0.08515727          1.00000000
  1  0  0  1  1
          0.03265748          1.00000000
  1  1  1  6  1
       1063.14747320          0.00246908
        251.56507061          0.01977335
         80.40855485          0.09098798
         29.76819327          0.25559900
         11.73683056          0.40489387
          4.71423752          0.23693403
  1  1  1  3  1
         17.79680370         -0.02787864
          2.42726987          0.55672915
          0.96823446          1.00554473
  1  1  1  1  1
          0.37056694          1.00000000
  1  2  2  4  1
         37.71338472          0.01151384
         10.69293118          0.06724634
          3.67284470          0.21484208
          1.35885903          0.38890893
  1  2  2  1  1
          0.49213295          1.00000000
  1  2  2  1  1
          0.16330521          1.00000000
  1  1  1  1  1
          0.10156100          1.00000000
# VANADIUM    (17s,10p,6d) -> [6s,3p,3d]
# VANADIUM    (1p)
V  Ahlrichs-pTZV
 13
  1  0  0  8  1
     232340.65058000          0.00023072
      34828.84117000          0.00178882
       7926.54486910          0.00929925
       2243.77330460          0.03776146
        730.59322944          0.12255910
        262.32219631          0.28963509
        101.70403805          0.41004703
         40.06478462          0.21113611
  1  0  0  4  1
        255.24014968         -0.02445812
         78.80464696         -0.11527205
         12.34059895          0.55174749
          5.17420192          0.54504528
  1  0  0  2  1
          7.65138945         -0.22967638
          1.26397599          0.71683769
  1  0  0  1  1
          0.53861762          1.00000000
  1  0  0  1  1
          0.09271930          1.00000000
  1  0  0  1  1
          0.03499806          1.00000000
  1  1  1  6  1
       1184.23691510          0.00244498
        280.23075192          0.01964345
         89.64362714          0.09079695
         33.24241125          0.25650768
         13.14451445          0.40815394
          5.29485341          0.23860378
  1  1  1  3  1
         20.17558685         -0.02824149
          2.76058652          0.55574636
          1.10089009          0.99319919
  1  1  1  1  1
          0.42013311          1.00000000
  1  2  2  4  1
         43.86113486          0.01148717
         12.51602189          0.06824715
          4.33138550          0.21837784
          1.61388558          0.39245212
  1  2  2  1  1
          0.58749574          1.00000000
  1  2  2  1  1
          0.19515723          1.00000000
  1  1  1  1  1
          0.11124800          1.00000000
# CHROMIUM    (17s,10p,6d) -> [6s,3p,3d]
# CHROMIUM    (1p)
CR Ahlrichs-pTZV
 13
  1  0  0  8  1
     254477.80704000          0.00023387
      38131.79705400          0.00181426
       8675.29306070          0.00943639
       2455.00998480          0.03834364
        799.16217787          0.12459195
        286.90021489          0.29489696
        111.25413232          0.41846150
         43.86415264          0.21633763
  1  0  0  4  1
        279.32669173         -0.02345091
         86.27473238         -0.11080370
         13.55575611          0.53028966
          5.69781128          0.51603517
  1  0  0  2  1
          8.56365826         -0.38109546
          1.39882968          1.19915914
  1  0  0  1  1
          0.57288171          1.00000000
  1  0  0  1  1
          0.09009617          1.00000000
  1  0  0  1  1
          0.03412589          1.00000000
  1  1  1  6  1
       1306.43988640          0.00242773
        309.25311441          0.01954404
         98.99627396          0.09065179
         36.75691645          0.25699279
         14.56665708          0.40935505
          5.87399374          0.23729389
  1  1  1  3  1
         22.89099970         -0.02816603
          3.08550018          0.56034120
          1.21323291          0.98119020
  1  1  1  1  1
          0.44931681          1.00000000
  1  2  2  4  1
         43.72007448          0.01362296
         12.39124265          0.07893518
          4.26394420          0.23833840
          1.55252218          0.39526851
  1  2  2  1  1
          0.53761929          1.00000000
  1  2  2  1  1
          0.16493173          1.00000000
  1  1  1  1  1
          0.12067500          1.00000000
# MANGANESE   (17s,10p,6d) -> [6s,3p,3d]
# MANGANESE   (1p)
MN Ahlrichs-pTZV
 13
  1  0  0  8  1
     277185.00153000          0.00022838
      41550.76989000          0.00177077
       9455.97001520          0.00920772
       2676.52064820          0.03741597
        871.46687530          0.12164861
        312.98306420          0.28824392
        121.44454051          0.41041601
         47.92259883          0.21372375
  1  0  0  4  1
        303.66723163         -0.02458993
         93.88140319         -0.11602608
         14.87942121          0.55112060
          6.28652007          0.53707561
  1  0  0  2  1
          9.48585913         -0.22889263
          1.56987062          0.71196170
  1  0  0  1  1
          0.65903214          1.00000000
  1  0  0  1  1
          0.10686292          1.00000000
  1  0  0  1  1
          0.03926744          1.00000000
  1  1  1  6  1
       1444.79781820          0.00239941
        342.06551197          0.01936929
        109.58400891          0.09023611
         40.74798817          0.25745468
         16.18862657          0.41272352
          6.54845060          0.24087700
  1  1  1  3  1
         25.35708644         -0.02870717
          3.48301688          0.55208101
          1.38588009          0.97226901
  1  1  1  1  1
          0.52555095          1.00000000
  1  2  2  4  1
         56.56318912          0.01154325
         16.27873471          0.07029985
          5.69642739          0.22450771
          2.14111479          0.39703065
  1  2  2  1  1
          0.78291802          1.00000000
  1  2  2  1  1
          0.25952311          1.00000000
  1  1  1  1  1
          0.12765000          1.00000000
# IRON        (17s,10p,6d) -> [6s,3p,3d]
# IRON        (1p)
FE Ahlrichs-pTZV
 13
  1  0  0  8  1
     300784.84637000          0.00022806
      45088.97055700          0.00176818
      10262.51631700          0.00919271
       2905.28972930          0.03735550
        946.11487137          0.12151108
        339.87832894          0.28818881
        131.94425588          0.41126613
         52.11149408          0.21518584
  1  0  0  4  1
        329.48839267         -0.02474522
        101.92332739         -0.11683089
         16.24046274          0.55293621
          6.88406758          0.53601640
  1  0  0  2  1
         10.47069378         -0.22912709
          1.73600396          0.71159320
  1  0  0  1  1
          0.72577289          1.00000000
  1  0  0  1  1
          0.11595528          1.00000000
  1  0  0  1  1
          0.04196823          1.00000000
  1  1  1  6  1
       1585.39599700          0.00237940
        375.38006499          0.01925315
        120.31816501          0.09002184
         44.78874903          0.25798172
         17.82927858          0.41492650
          7.22471538          0.24207475
  1  1  1  3  1
         28.14321976         -0.02904176
          3.87432414          0.55312260
          1.54107523          0.96771137
  1  1  1  1  1
          0.58285615          1.00000000
  1  2  2  4  1
         61.99667503          0.01197197
         17.87373255          0.07321014
          6.27447829          0.23103094
          2.35523372          0.39910706
  1  2  2  1  1
          0.85432240          1.00000000
  1  2  2  1  1
          0.27869254          1.00000000
  1  1  1  1  1
          0.13491500          1.00000000
# COBALT      (17s,10p,6d) -> [6s,3p,3d]
# COBALT      (1p)
CO Ahlrichs-pTZV
 13
  1  0  0  8  1
     325817.01553000          0.00022568
      48839.63645300          0.00174994
      11114.93730700          0.00910031
       3146.16036420          0.03699626
       1024.43784650          0.12044270
        368.02508816          0.28598732
        142.91229205          0.40908312
         56.48264921          0.21500146
  1  0  0  4  1
        356.40298318         -0.02476706
        110.31165215         -0.11702139
         17.65963483          0.55215522
          7.50590305          0.53246877
  1  0  0  2  1
         11.50180718         -0.22942470
          1.90819946          0.71180934
  1  0  0  1  1
          0.79396697          1.00000000
  1  0  0  1  1
          0.12444449          1.00000000
  1  0  0  1  1
          0.04444465          1.00000000
  1  1  1  6  1
       1731.13691440          0.00239058
        409.91750438          0.01938300
        131.45648578          0.09090545
         48.98743971          0.26146682
         19.53707899          0.42157265
          7.92872816          0.24571814
  1  1  1  3  1
         31.07601758         -0.02943807
          4.28351807          0.55615568
          1.70229216          0.96772195
  1  1  1  1  1
          0.64202909          1.00000000
  1  2  2  4  1
         68.14074524          0.01198385
         19.68524102          0.07368854
          6.93221288          0.23085497
          2.60251257          0.39281059
  1  2  2  1  1
          0.94016837          0.49652611
  1  2  2  1  1
          0.30381458          0.32719933
  1  1  1  1  1
          0.14130800          1.00000000
# NICKEL      (17s,10p,6d) -> [6s,3p,3d]
# NICKEL      (1p)
NI Ahlrichs-pTZV
 13
  1  0  0  8  1
     351535.72935000          0.00022529
      52695.80928300          0.00174686
      11992.46829300          0.00908500
       3394.57766890          0.03694075
       1105.35945850          0.12032820
        397.14677769          0.28596715
        154.27542974          0.40983020
         61.01872378          0.21620643
  1  0  0  4  1
        384.45559739         -0.02465128
        119.04879199         -0.11658505
         19.13701222          0.54864127
          8.15267186          0.52640051
  1  0  0  2  1
         12.57940864         -0.22797884
          2.08708661          0.70703738
  1  0  0  1  1
          0.86432569          1.00000000
  1  0  0  1  1
          0.13283169          1.00000000
  1  0  0  1  1
          0.04684533          1.00000000
  1  1  1  6  1
       1883.09074860          0.00237483
        445.95155320          0.01928946
        143.08430815          0.09071821
         53.37292072          0.26181414
         21.32191936          0.42309150
          8.66435620          0.24641686
  1  1  1  3  1
         34.14425521         -0.02967713
          4.71224559          0.55616824
          1.87092318          0.96357766
  1  1  1  1  1
          0.70370016          1.00000000
  1  2  2  4  1
         74.59160347          0.01207745
         21.59063275          0.07463726
          7.62461426          0.23236776
          2.86322068          0.39042652
  1  2  2  1  1
          1.03110634          0.51501528
  1  2  2  1  1
          0.33060761          0.33962671
  1  1  1  1  1
          0.14658800          1.00000000
# COPPER      (17s,10p,6d) -> [6s,3p,3d]
# COPPER      (1p)
CU Ahlrichs-pTZV
 13
  1  0  0  8  1
     377518.79923000          0.00022812
      56589.98431100          0.00176880
      12878.71170600          0.00919935
       3645.37521430          0.03741102
       1187.00729450          0.12189874
        426.46421902          0.28983901
        165.70660164          0.41531872
         65.59894271          0.21905799
  1  0  0  4  1
        414.41265811         -0.02468253
        128.32056039         -0.11716827
         20.62208975          0.55301316
          8.78212260          0.52242719
  1  0  0  2  1
         13.74137201         -0.22736062
          2.24312468          0.71761211
  1  0  0  1  1
          0.89370549          1.00000000
  1  0  0  1  1
          0.10836700          1.00000000
  1  0  0  1  1
          0.03880618          1.00000000
  1  1  1  6  1
       2034.75966920          0.00235248
        481.90468106          0.01913407
        154.67482963          0.09017111
         57.74057697          0.26063285
         23.09905281          0.42093486
          9.38824786          0.24344615
  1  1  1  3  1
         37.59617121         -0.02899109
          5.12406908          0.54919084
          2.01199961          0.93793330
  1  1  1  1  1
          0.73860686          1.00000000
  1  2  2  4  1
         74.12946064          0.01436322
         21.35984259          0.08662818
          7.49952405          0.25631431
          2.76013942          0.40374062
  1  2  2  1  1
          0.95362061          1.00000000
  1  2  2  1  1
          0.28420863          1.00000000
  1  1  1  1  1
          0.15506500          1.00000000
# ZINC        (17s,10p,6d) -> [6s,3p,3d]
# ZINC        (1p)
ZN Ahlrichs-pTZV
 13
  1  0  0  8  1
     405924.31028000          0.00022442
      60846.95573500          0.00174021
      13847.34309200          0.00905133
       3919.61585510          0.03681734
       1276.35941670          0.12004850
        458.67254435          0.28576058
        178.28725246          0.41087462
         70.61219284          0.21816962
  1  0  0  4  1
        443.88077950         -0.02493427
        137.55875267         -0.11817956
         22.26808348          0.55367318
          9.52173106          0.52628935
  1  0  0  2  1
         14.87411407         -0.22929955
          2.46475176          0.71135485
  1  0  0  1  1
          1.01132722          1.00000000
  1  0  0  1  1
          0.14919852          1.00000000
  1  0  0  1  1
          0.05144187          1.00000000
  1  1  1  6  1
       2205.35085340          0.00233562
        522.35300699          0.01903102
        167.73055542          0.08995576
         62.67004537          0.26113249
         25.10974946          0.42348448
         10.22514268          0.24618927
  1  1  1  3  1
         40.71344252         -0.03002967
          5.62470907          0.55575255
          2.22799491          0.95581013
  1  1  1  1  1
          0.83354742          1.00000000
  1  2  2  4  1
         88.55431531          0.01272817
         25.72152556          0.07939450
          9.12783676          0.24491507
          3.43123641          0.40390526
  1  2  2  1  1
          1.23089206          1.00000000
  1  2  2  1  1
          0.39031845          1.00000000
  1  1  1  1  1
          0.16245500          1.00000000
# GALLIUM     (17s,12p,6p) -> [6s,5p,2d]
# GALLIUM     (1d)
GA Ahlrichs-pTZV
 14
  1  0  0  8  1
     435548.66254000          0.00023646
      65289.58903100          0.00183353
      14858.78425600          0.00953719
       4205.97347290          0.03880341
       1369.64164310          0.12661605
        492.30348905          0.30175310
        191.41923233          0.43543934
         75.84055867          0.23282364
  1  0  0  4  1
        474.30810613         -0.02674371
        147.10297560         -0.12654658
         23.98259943          0.58840347
         10.29823009          0.56324272
  1  0  0  2  1
         16.05038143         -0.24516440
          2.69884688          0.74578050
  1  0  0  1  1
          1.14285887          1.00000000
  1  0  0  1  1
          0.20217652          1.00000000
  1  0  0  1  1
          0.07198015          1.00000000
  1  1  1  6  1
       2432.01710700          0.00224341
        576.12049582          0.01834227
        185.11584354          0.08727970
         69.24657256          0.25684868
         27.81810778          0.42398378
         11.42022994          0.25701340
  1  1  1  3  1
         42.81966153         -0.01932652
          6.38859010          0.31571387
          2.66989933          0.57617793
  1  1  1  1  1
          1.07817838          1.00000000
  1  1  1  1  1
          0.22796559          1.00000000
  1  1  1  1  1
          0.06283623          1.00000000
  1  2  2  5  1
        103.92331829          0.01146461
         30.37109439          0.07362575
         10.87207810          0.23505107
          4.15491380          0.40318564
          1.53456591          0.40824748
  1  2  2  1  1
          0.51114264          1.00000000
  1  2  2  1  1
          0.20700000          1.00000000
# GERMANIUM   (17s,12p,6p) -> [6s,5p,2d]
# GERMANIUM   (1d)
GE Ahlrichs-pTZV
 14
  1  0  0  8  1
     466115.00592000          0.00022487
      69875.42076200          0.00174354
      15903.27671600          0.00906915
       4501.82334530          0.03690617
       1466.05709240          0.12050168
        527.07841728          0.28748642
        205.00395074          0.41622322
         81.25159607          0.22397846
  1  0  0  4  1
        505.74661282         -0.02518461
        156.96593744         -0.11898930
         25.76144818          0.54930136
         11.10665469          0.52939309
  1  0  0  2  1
         17.27205910         -0.22854596
          2.94382890          0.68377930
  1  0  0  1  1
          1.28391649          1.00000000
  1  0  0  1  1
          0.25873337          1.00000000
  1  0  0  1  1
          0.09352491          1.00000000
  1  1  1  6  1
       2633.93462410          0.00221439
        624.00161628          0.01814090
        200.58528404          0.08663218
         75.09708153          0.25649021
         30.21438847          0.42658611
         12.44008757          0.26200527
  1  1  1  3  1
         45.98131600         -0.02032177
          6.99456544          0.32013745
          2.96860013          0.59051015
  1  1  1  1  1
          1.23209885          1.00000000
  1  1  1  1  1
          0.28981615          1.00000000
  1  1  1  1  1
          0.08556461          1.00000000
  1  2  2  5  1
        119.44887581          0.01058654
         35.06291529          0.06960128
         12.63692453          0.22807035
          4.88886729          0.40301067
          1.84531954          0.41304847
  1  2  2  1  1
          0.63571159          1.00000000
  1  2  2  1  1
          0.24600000          1.00000000
# ARSENIC     (17s,13p,6p) -> [6s,5p,2d]
# ARSENIC     (1d)
AS Ahlrichs-pTZV
 14
  1  0  0  8  1
     498032.42158000          0.00022740
      74656.86874300          0.00176328
      16990.96000400          0.00917280
       4809.62003210          0.03733783
       1566.28870550          0.12199536
        563.21360499          0.29137475
        219.11179978          0.42326351
         86.86606103          0.22921464
  1  0  0  4  1
        538.19512479         -0.02525420
        167.14850224         -0.11915461
         27.60551716          0.54628496
         11.94785852          0.53001521
  1  0  0  2  1
         18.53802313         -0.23479188
          3.20189857          0.69167053
  1  0  0  1  1
          1.43565221          1.00000000
  1  0  0  1  1
          0.31837805          1.00000000
  1  0  0  1  1
          0.11622632          1.00000000
  1  1  1  6  1
       2678.94215460          0.00233190
        634.61765840          0.01904215
        203.93967606          0.09022974
         76.32389037          0.26169038
         30.66412494          0.41857168
         12.50505673          0.23447830
  1  1  1  4  1
         49.25622955         -0.02123554
          7.72748915          0.30470207
          3.54104935          0.52888373
          1.69855855          0.37272251
  1  1  1  1  1
          0.76848071          1.00000000
  1  1  1  1  1
          0.30050823         -0.35023592
  1  1  1  1  1
          0.09819064          1.00000000
  1  2  2  5  1
        135.33289305          0.00992911
         39.86021274          0.06656884
         14.44642836          0.22275768
          5.64329004          0.40309224
          2.16681886          0.41671668
  1  2  2  1  1
          0.76514971          1.00000000
  1  2  2  1  1
          0.29300000          1.00000000
# SELENIUM    (17s,13p,6p) -> [6s,5p,2d]
# SELENIUM    (1d)
SE Ahlrichs-pTZV
 14
  1  0  0  8  1
     531071.66696000          0.00024109
      79603.04411700          0.00186964
      18115.84424000          0.00972716
       5127.89231940          0.03960479
       1669.91308390          0.12948855
        600.57534527          0.30959437
        233.70021247          0.45115769
         92.67244393          0.24579189
  1  0  0  4  1
        571.57513675         -0.02689571
        177.63686375         -0.12670989
         29.51776705          0.57699002
         12.82439979          0.56369075
  1  0  0  2  1
         19.84823584         -0.25132416
          3.47440185          0.72905417
  1  0  0  1  1
          1.59889108          1.00000000
  1  0  0  1  1
          0.38333469          1.00000000
  1  0  0  1  1
          0.14049742          1.00000000
  1  1  1  6  1
       2815.35005660          0.00255690
        666.92558298          0.02087403
        214.34213188          0.09877210
         80.24668794          0.28471821
         32.25108129          0.45003585
         13.10643256          0.24416091
  1  1  1  4  1
         53.36610852         -0.02155846
          8.18277772          0.32662311
          3.62399457          0.57740499
          1.63415914          0.34301321
  1  1  1  1  1
          0.58418320          1.00000000
  1  1  1  1  1
          0.23966269          1.00000000
  1  1  1  1  1
          0.08878513          1.00000000
  1  2  2  5  1
        151.82910279          0.00939703
         44.83999252          0.06408650
         16.32899951          0.21834238
          6.43050576          0.40314790
          2.50480252          0.41966491
  1  2  2  1  1
          0.90271148          1.00000000
  1  2  2  1  1
          0.33800000          1.00000000
# BROMINE     (17s,13p,6p) -> [6s,5p,2d]
# BROMINE     (1d)
BR Ahlrichs-pTZV
 14
  1  0  0  8  1
     565073.25256000          0.00023660
      84701.72317900          0.00183483
      19276.27190000          0.00954658
       5456.42845760          0.03887714
       1776.95035000          0.12718314
        639.19398276          0.30437662
        248.78823961          0.44490940
         98.67830549          0.24381643
  1  0  0  4  1
        606.07824568         -0.02652716
        188.45598484         -0.12484585
         31.49714451          0.56468684
         13.73600832          0.55555269
  1  0  0  2  1
         21.20321277         -0.24940920
          3.76164202          0.71213120
  1  0  0  1  1
          1.77359340          1.00000000
  1  0  0  1  1
          0.45197414          1.00000000
  1  0  0  1  1
          0.16613377          1.00000000
  1  1  1  6  1
       3019.69557230          0.00249710
        715.35481126          0.02041927
        229.98328751          0.09689715
         86.16784462          0.28053901
         34.66787080          0.44606390
         14.11387031          0.24410074
  1  1  1  4  1
         57.08565308         -0.02185595
          8.81938458          0.32707075
          3.93403029          0.57855230
          1.79988304          0.33570988
  1  1  1  1  1
          0.66899411          1.00000000
  1  1  1  1  1
          0.27136238          1.00000000
  1  1  1  1  1
          0.10083790          1.00000000
  1  2  2  5  1
        168.85370257          0.00896640
         49.97794992          0.06206206
         18.27491334          0.21474732
          7.24556946          0.40335337
          2.85623150          0.42208813
  1  2  2  1  1
          1.04596211          1.00000000
  1  2  2  1  1
          0.38900000          1.00000000
# KRYPTON     (17s,13p,6p) -> [6s,5p,2d]
# KRYPTON     (1d)
KR Ahlrichs-pTZV
 14
  1  0  0  8  1
     600250.97575000          0.00023741
      89976.65078100          0.00184102
      20476.81422500          0.00957956
       5796.15540780          0.03902065
       1887.59131960          0.12772646
        679.11458519          0.30596521
        264.38244511          0.44857474
        104.88368574          0.24722957
  1  0  0  4  1
        641.47370764         -0.02674528
        199.57524820         -0.12571123
         33.54546295          0.56483736
         14.68395514          0.55972766
  1  0  0  2  1
         22.60310186         -0.25298772
          4.06506830          0.70992160
  1  0  0  1  1
          1.96110271          1.00000000
  1  0  0  1  1
          0.52465148          1.00000000
  1  0  0  1  1
          0.19332400          1.00000000
  1  1  1  6  1
       3232.95896140          0.00248856
        765.96442694          0.02037901
        246.33940810          0.09697719
         92.36528304          0.28199961
         37.19950955          0.45116254
         15.17216653          0.24917131
  1  1  1  4  1
         60.93132170         -0.02217360
          9.47926006          0.32838463
          4.25646863          0.58124997
          1.97293138          0.32863542
  1  1  1  1  1
          0.76337109          1.00000000
  1  1  1  1  1
          0.30943626          0.55671931
  1  1  1  1  1
          0.11569704          1.00000000
  1  2  2  5  1
        186.41760904          0.00861203
         55.27412435          0.06039441
         20.28321912          0.21181332
          8.08845370          0.40366293
          3.22140339          0.42402861
  1  2  2  1  1
          1.19521701          1.00000000
  1  2  2  1  1
          0.44300000          1.00000000
# BASIS="aug-cc-pVDZ"
#Elements                             References
#--------                             ----------
# H     : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He    : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
#Li - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#Na - Mg: D.E. Woon and T.H. Dunning, Jr.  (to be published)
#Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
#Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#Elements                             References
#--------                             ---------
# H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
# B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#         6769 (1992).
#Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN    (4s,1p) -> [2s,1p]
# HYDROGEN    Diffuse (1s,1p)
H  aug-cc-pVDZ
  5
  1  0  0  3  1
         13.01000000          0.01968500
          1.96200000          0.13797700
          0.44460000          0.47814800
  1  0  0  1  1
          0.12200000          1.00000000
  1  1  1  1  1
          0.72700000          1.00000000
  1  0  0  1  1
          0.02974000          1.00000000
  1  1  1  1  1
          0.14100000          1.00000000
# HELIUM      (4s,1p) -> [2s,1p]
# HELIUM      Diffuse (1s,1p)
HE aug-cc-pVDZ
  5
  1  0  0  3  1
         38.36000000          0.02380900
          5.77000000          0.15489100
          1.24000000          0.46998700
  1  0  0  1  1
          0.29760000          1.00000000
  1  1  1  1  1
          1.27500000          1.00000000
  1  0  0  1  1
          0.07255000          1.00000000
  1  1  1  1  1
          0.24730000          1.00000000
# BORON       (9s,4p,1d) -> [3s,2p,1d]
# BORON       Diffuse (1s,1p,1d)
B  aug-cc-pVDZ
  8
  1  0  0  8  2
       4570.00000000          0.00069600         -0.00013900
        685.90000000          0.00535300         -0.00109700
        156.50000000          0.02713400         -0.00544400
         44.47000000          0.10138000         -0.02191600
         14.48000000          0.27205500         -0.05975100
          5.13100000          0.44840300         -0.13873200
          1.89800000          0.29012300         -0.13148200
          0.33290000          0.01432200          0.53952600
  1  0  0  1  1
          0.10430000          1.00000000
  1  1  1  3  1
          6.00100000          0.03548100
          1.24100000          0.19807200
          0.33640000          0.50523000
  1  1  1  1  1
          0.09538000          1.00000000
  1  2  2  1  1
          0.34300000          1.00000000
  1  0  0  1  1
          0.03105000          1.00000000
  1  1  1  1  1
          0.02378000          1.00000000
  1  2  2  1  1
          0.09040000          1.00000000
# CARBON      (9s,4p,1d) -> [3s,2p,1d]
# CARBON      Diffuse (1s,1p,1d)
C  aug-cc-pVDZ
  8
  1  0  0  8  2
       6665.00000000          0.00069200         -0.00014600
       1000.00000000          0.00532900         -0.00115400
        228.00000000          0.02707700         -0.00572500
         64.71000000          0.10171800         -0.02331200
         21.06000000          0.27474000         -0.06395500
          7.49500000          0.44856400         -0.14998100
          2.79700000          0.28507400         -0.12726200
          0.52150000          0.01520400          0.54452900
  1  0  0  1  1
          0.15960000          1.00000000
  1  1  1  3  1
          9.43900000          0.03810900
          2.00200000          0.20948000
          0.54560000          0.50855700
  1  1  1  1  1
          0.15170000          1.00000000
  1  2  2  1  1
          0.55000000          1.00000000
  1  0  0  1  1
          0.04690000          1.00000000
  1  1  1  1  1
          0.04041000          1.00000000
  1  2  2  1  1
          0.15100000          1.00000000
# NITROGEN    (9s,4p,1d) -> [3s,2p,1d]
# NITROGEN    Diffuse (1s,1p,1d)
N  aug-cc-pVDZ
  8
  1  0  0  8  2
       9046.00000000          0.00070000         -0.00015300
       1357.00000000          0.00538900         -0.00120800
        309.30000000          0.02740600         -0.00599200
         87.73000000          0.10320700         -0.02454400
         28.56000000          0.27872300         -0.06745900
         10.21000000          0.44854000         -0.15807800
          3.83800000          0.27823800         -0.12183100
          0.74660000          0.01544000          0.54900300
  1  0  0  1  1
          0.22480000          1.00000000
  1  1  1  3  1
         13.55000000          0.03991900
          2.91700000          0.21716900
          0.79730000          0.51031900
  1  1  1  1  1
          0.21850000          1.00000000
  1  2  2  1  1
          0.81700000          1.00000000
  1  0  0  1  1
          0.06124000          1.00000000
  1  1  1  1  1
          0.05611000          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
# OXYGEN      (9s,4p,1d) -> [3s,2p,1d]
# OXYGEN      Diffuse (1s,1p,1d)
O  aug-cc-pVDZ
  8
  1  0  0  8  2
      11720.00000000          0.00071000         -0.00016000
       1759.00000000          0.00547000         -0.00126300
        400.80000000          0.02783700         -0.00626700
        113.70000000          0.10480000         -0.02571600
         37.03000000          0.28306200         -0.07092400
         13.27000000          0.44871900         -0.16541100
          5.02500000          0.27095200         -0.11695500
          1.01300000          0.01545800          0.55736800
  1  0  0  1  1
          0.30230000          1.00000000
  1  1  1  3  1
         17.70000000          0.04301800
          3.85400000          0.22891300
          1.04600000          0.50872800
  1  1  1  1  1
          0.27530000          1.00000000
  1  2  2  1  1
          1.18500000          1.00000000
  1  0  0  1  1
          0.07896000          1.00000000
  1  1  1  1  1
          0.06856000          1.00000000
  1  2  2  1  1
          0.33200000          1.00000000
# FLUORINE    (9s,4p,1d) -> [3s,2p,1d]
# FLUORINE    Diffuse (1s,1p,1d)
F  aug-cc-pVDZ
  8
  1  0  0  8  2
      14710.00000000          0.00072100         -0.00016500
       2207.00000000          0.00555300         -0.00130800
        502.80000000          0.02826700         -0.00649500
        142.60000000          0.10644400         -0.02669100
         46.47000000          0.28681400         -0.07369000
         16.70000000          0.44864100         -0.17077600
          6.35600000          0.26476100         -0.11232700
          1.31600000          0.01533300          0.56281400
  1  0  0  1  1
          0.38970000          1.00000000
  1  1  1  3  1
         22.67000000          0.04487800
          4.97700000          0.23571800
          1.34700000          0.50852100
  1  1  1  1  1
          0.34710000          1.00000000
  1  2  2  1  1
          1.64000000          1.00000000
  1  0  0  1  1
          0.09863000          1.00000000
  1  1  1  1  1
          0.08502000          1.00000000
  1  2  2  1  1
          0.46400000          1.00000000
# NEON        (9s,4p,1d) -> [3s,2p,1d]
# NEON        Diffuse (1s,1p,1d)
NE aug-cc-pVDZ
  8
  1  0  0  8  2
      17880.00000000          0.00073800         -0.00017200
       2683.00000000          0.00567700         -0.00135700
        611.50000000          0.02888300         -0.00673700
        173.50000000          0.10854000         -0.02766300
         56.64000000          0.29090700         -0.07620800
         20.42000000          0.44832400         -0.17522700
          7.81000000          0.25802600         -0.10703800
          1.65300000          0.01506300          0.56705000
  1  0  0  1  1
          0.48690000          1.00000000
  1  1  1  3  1
         28.39000000          0.04608700
          6.27000000          0.24018100
          1.69500000          0.50874400
  1  1  1  1  1
          0.43170000          1.00000000
  1  2  2  1  1
          2.20200000          1.00000000
  1  0  0  1  1
          0.12300000          1.00000000
  1  1  1  1  1
          0.10640000          1.00000000
  1  2  2  1  1
          0.63100000          1.00000000
# ALUMINUM    (12s,8p,1d) -> [4s,3p,1d]
# ALUMINUM    Diffuse (1s,1p,1d)
AL aug-cc-pVDZ
  8
  1  0  0 11  3
      64150.00000000          0.00029025         -0.00007580          0.00001751
       9617.00000000          0.00225064         -0.00058179          0.00013421
       2189.00000000          0.01164590         -0.00308113          0.00071244
        620.50000000          0.04673770         -0.01231120          0.00284330
        202.70000000          0.14629900         -0.04197810          0.00976842
         73.15000000          0.33028300         -0.10337100          0.02418500
         28.55000000          0.41586100         -0.19630800          0.04749930
         11.77000000          0.18925300         -0.08300020          0.02036210
          3.30000000          0.01158890          0.54104000         -0.15878800
          1.17300000         -0.00128385          0.57879600         -0.31169400
          0.17520000          0.00042588          0.02881470          0.62014700
  1  0  0  1  1
          0.06473000          1.00000000
  1  1  1  7  2
        258.80000000          0.00406847         -0.00074805
         60.89000000          0.03068150         -0.00545796
         19.14000000          0.12914900         -0.02453710
          6.88100000          0.32083100         -0.05821380
          2.57400000          0.45381500         -0.09837560
          0.95720000          0.27506600         -0.02600640
          0.20990000          0.01908070          0.46402000
  1  1  1  1  1
          0.05986000          1.00000000
  1  2  2  1  1
          0.18900000          1.00000000
  1  0  0  1  1
          0.02310000          1.00000000
  1  1  1  1  1
          0.01530000          1.00000000
  1  2  2  1  1
          0.05350000          1.00000000
# SILICON     (12s,8p,1d) -> [4s,3p,1d]
# SILICON     Diffuse (1s,1p,1d)
SI aug-cc-pVDZ
  8
  1  0  0 11  3
      78860.00000000          0.00027044         -0.00007232          0.00001851
      11820.00000000          0.00209717         -0.00055512          0.00014224
       2692.00000000          0.01085060         -0.00293805          0.00075219
        763.40000000          0.04367540         -0.01176870          0.00302279
        249.60000000          0.13765300         -0.04029070          0.01036770
         90.28000000          0.31664400         -0.10060900          0.02625630
         35.29000000          0.41858100         -0.19652800          0.05239890
         14.51000000          0.21021200         -0.10238200          0.02909590
          4.05300000          0.01449520          0.52719000         -0.17800300
          1.48200000         -0.00203590          0.59325100         -0.34687400
          0.25170000          0.00062419          0.03326520          0.62302000
  1  0  0  1  1
          0.09243000          1.00000000
  1  1  1  7  2
        315.90000000          0.00392656         -0.00085830
         74.42000000          0.02988110         -0.00630328
         23.48000000          0.12721200         -0.02882550
          8.48800000          0.32094300         -0.06945600
          3.21700000          0.45542900         -0.11949300
          1.22900000          0.26856300         -0.01995810
          0.29640000          0.01883360          0.51026800
  1  1  1  1  1
          0.08768000          1.00000000
  1  2  2  1  1
          0.27500000          1.00000000
  1  0  0  1  1
          0.03320000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  2  2  1  1
          0.08230000          1.00000000
# PHOSPHORUS  (12s,8p,1d) -> [4s,3p,1d]
# PHOSPHORUS  Diffuse (1s,1p,1d)
P  aug-cc-pVDZ
  8
  1  0  0 11  3
      94840.00000000          0.00025551         -0.00006969          0.00001912
      14220.00000000          0.00198193         -0.00053527          0.00014722
       3236.00000000          0.01027600         -0.00283709          0.00077791
        917.10000000          0.04148230         -0.01139830          0.00314546
        299.50000000          0.13198400         -0.03929290          0.01082000
        108.10000000          0.30866200         -0.09963640          0.02799570
         42.18000000          0.42064700         -0.19798300          0.05639780
         17.28000000          0.22287800         -0.11486000          0.03581900
          4.85800000          0.01640350          0.51859500         -0.19338700
          1.81800000         -0.00254255          0.60184700         -0.37209700
          0.33720000          0.00074805          0.03686120          0.62424600
  1  0  0  1  1
          0.12320000          1.00000000
  1  1  1  7  2
        370.50000000          0.00395005         -0.00095983
         87.33000000          0.03024920         -0.00711177
         27.59000000          0.12955400         -0.03271220
         10.00000000          0.32759400         -0.07957840
          3.82500000          0.45699200         -0.13501600
          1.49400000          0.25308600         -0.00910585
          0.39210000          0.01687980          0.53780200
  1  1  1  1  1
          0.11860000          1.00000000
  1  2  2  1  1
          0.37300000          1.00000000
  1  0  0  1  1
          0.04170000          1.00000000
  1  1  1  1  1
          0.03430000          1.00000000
  1  2  2  1  1
          0.11300000          1.00000000
# SULFUR      (12s,8p,1d) -> [4s,3p,1d]
# SULFUR      Diffuse (1s,1p,1d)
S  aug-cc-pVDZ
  8
  1  0  0 11  3
     110800.00000000          0.00024764         -0.00006870          0.00001991
      16610.00000000          0.00192026         -0.00052768          0.00015348
       3781.00000000          0.00996192         -0.00279671          0.00080950
       1071.00000000          0.04029750         -0.01126510          0.00328974
        349.80000000          0.12860400         -0.03888340          0.01129670
        126.30000000          0.30348000         -0.09950250          0.02963850
         49.26000000          0.42143200         -0.19974000          0.05998510
         20.16000000          0.23078100         -0.12336000          0.04132480
          5.72000000          0.01789710          0.51319400         -0.20747400
          2.18200000         -0.00297516          0.60712000         -0.39288900
          0.43270000          0.00084952          0.03967530          0.63284000
  1  0  0  1  1
          0.15700000          1.00000000
  1  1  1  7  2
        399.70000000          0.00447541         -0.00116251
         94.19000000          0.03417080         -0.00865664
         29.75000000          0.14425000         -0.03908860
         10.77000000          0.35392800         -0.09346250
          4.11900000          0.45908500         -0.14799400
          1.62500000          0.20638300          0.03019040
          0.47260000          0.01021410          0.56157300
  1  1  1  1  1
          0.14070000          1.00000000
  1  2  2  1  1
          0.47900000          1.00000000
  1  0  0  1  1
          0.05070000          1.00000000
  1  1  1  1  1
          0.03990000          1.00000000
  1  2  2  1  1
          0.15200000          1.00000000
# CHLORINE    (12s,8p,1d) -> [4s,3p,1d]
# CHLORINE    Diffuse (1s,1p,1d)
CL aug-cc-pVDZ
  8
  1  0  0 11  3
     127900.00000000          0.00024115         -0.00006789          0.00002050
      19170.00000000          0.00187095         -0.00052184          0.00015830
       4363.00000000          0.00970827         -0.00276513          0.00083364
       1236.00000000          0.03931530         -0.01115370          0.00339880
        403.60000000          0.12593200         -0.03859190          0.01167380
        145.70000000          0.29934100         -0.09948480          0.03096220
         56.81000000          0.42188600         -0.20139200          0.06295330
         23.23000000          0.23720100         -0.13031300          0.04602570
          6.64400000          0.01915310          0.50944300         -0.21931200
          2.57500000         -0.00334792          0.61072500         -0.40877300
          0.53710000          0.00092988          0.04215490          0.63846500
  1  0  0  1  1
          0.19380000          1.00000000
  1  1  1  7  2
        417.60000000          0.00525982         -0.00143570
         98.33000000          0.03983320         -0.01077960
         31.04000000          0.16465500         -0.04700750
         11.19000000          0.38732200         -0.11103000
          4.24900000          0.45707200         -0.15327500
          1.62400000          0.15163600          0.08946090
          0.53220000          0.00181615          0.57944400
  1  1  1  1  1
          0.16200000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  0  0  1  1
          0.06080000          1.00000000
  1  1  1  1  1
          0.04660000          1.00000000
  1  2  2  1  1
          0.19600000          1.00000000
# ARGON       (12s,8p,1d) -> [4s,3p,1d]
# ARGON       Diffuse (1s,1p,1d)
AR aug-cc-pVDZ
  8
  1  0  0 11  3
     145700.00000000          0.00023670         -0.00006749          0.00002105
      21840.00000000          0.00183523         -0.00051852          0.00016257
       4972.00000000          0.00952860         -0.00274825          0.00085546
       1408.00000000          0.03862830         -0.01110070          0.00349745
        459.70000000          0.12408100         -0.03848200          0.01201560
        165.90000000          0.29647100         -0.09975990          0.03213680
         64.69000000          0.42206800         -0.20308800          0.06552790
         26.44000000          0.24171100         -0.13560800          0.04993700
          7.62800000          0.02005090          0.50719500         -0.22976900
          2.99600000         -0.00361000          0.61289800         -0.42100600
          0.65040000          0.00097561          0.04429680          0.64233100
  1  0  0  1  1
          0.23370000          1.00000000
  1  1  1  7  2
        453.70000000          0.00570555         -0.00160655
        106.80000000          0.04304600         -0.01217140
         33.73000000          0.17659100         -0.05207890
         12.13000000          0.40686300         -0.12373700
          4.59400000          0.45254900         -0.15161900
          1.67800000          0.12280100          0.14242500
          0.59090000         -0.00445996          0.58450100
  1  1  1  1  1
          0.18520000          1.00000000
  1  2  2  1  1
          0.73800000          1.00000000
  1  0  0  1  1
          0.07090000          1.00000000
  1  1  1  1  1
          0.05330000          1.00000000
  1  2  2  1  1
          0.24000000          1.00000000
# GALLIUM     (14s,11p,6d) -> [5s,4p,2d]
# GALLIUM     Diffuse (1s,1p,1d)
GA aug-cc-pVDZ
  9
  1  0  0 13  4
     485130.00000000          0.00020680         -0.00006430          0.00002450         -0.00000570
      72719.00000000          0.00160470         -0.00049540          0.00018950         -0.00004400
      16552.00000000          0.00834020         -0.00262080          0.00099640         -0.00023050
       4687.80000000          0.03402480         -0.01068390          0.00410820         -0.00095440
       1529.10000000          0.11116990         -0.03741230          0.01429380         -0.00330550
        551.81000000          0.27539300         -0.10096360          0.03980340         -0.00928880
        215.18000000          0.42126280         -0.21451410          0.08559400         -0.01986440
         88.17400000          0.27389060         -0.17522970          0.07963050         -0.01908880
         27.15400000          0.02837200          0.48315990         -0.29391070          0.07323560
         11.50300000         -0.00629310          0.63236770         -0.52639140          0.13415260
          3.30180000          0.00206060          0.06849420          0.58642490         -0.18319290
          1.33140000         -0.00092690         -0.01187120          0.67263470         -0.35713080
          0.19316000          0.00022730          0.00266520          0.02761230          0.62460130
  1  0  0  1  1
          0.07089500          1.00000000
  1  1  1 10  3
       3248.60000000          0.00152600         -0.00058030          0.00009500
        769.97000000          0.01274860         -0.00486470          0.00078320
        248.20000000          0.06337420         -0.02483940          0.00408550
         93.36400000          0.20657750         -0.08417590          0.01359870
         38.25100000          0.40929630         -0.18008850          0.03026950
         16.42200000          0.39191830         -0.15855550          0.02417900
          6.79180000          0.10294410          0.23553760         -0.04237770
          2.83360000         -0.00072030          0.58205870         -0.12656610
          1.10620000          0.00209500          0.33666190         -0.04994440
          0.22250000         -0.00032900          0.01719120          0.44941990
  1  1  1  1  1
          0.06177200          1.00000000
  1  2  2  5  1
         65.33700000          0.02738250
         18.49700000          0.15108050
          6.31500000          0.37492170
          2.16350000          0.47507990
          0.66675000          0.29827500
  1  2  2  1  1
          0.18840000          1.00000000
  1  0  0  1  1
          0.02434800          1.00000000
  1  1  1  1  1
          0.01516400          1.00000000
  1  2  2  1  1
          0.05370000          1.00000000
# GERMANIUM   (14s,11p,6d) -> [5s,4p,2d]
# GERMANIUM   Diffuse (1s,1p,1d)
GE aug-cc-pVDZ
  9
  1  0  0 13  4
     521800.00000000          0.00020450         -0.00006380          0.00002460         -0.00000630
      78214.00000000          0.00158680         -0.00049160          0.00019000         -0.00004860
      17803.00000000          0.00824800         -0.00260020          0.00099930         -0.00025530
       5041.90000000          0.03366490         -0.01060800          0.00412000         -0.00105600
       1644.50000000          0.11012490         -0.03716020          0.01435570         -0.00366740
        593.43000000          0.27356070         -0.10057900          0.04003750         -0.01030530
        231.36000000          0.42106700         -0.21439770          0.08657940         -0.02222000
         94.76200000          0.27667910         -0.17826170          0.08158610         -0.02152750
         29.27400000          0.02921800          0.47774040         -0.29347700          0.08067520
         12.45000000         -0.00659030          0.63559830         -0.53679830          0.15249580
          3.64630000          0.00224300          0.07221740          0.56379850         -0.19805280
          1.50250000         -0.00103820         -0.01272650          0.69471820         -0.40739540
          0.24503000          0.00026950          0.00296080          0.03157300          0.64772880
  1  0  0  1  1
          0.09159400          1.00000000
  1  1  1 10  3
       3568.10000000          0.00145910         -0.00056300          0.00011150
        845.72000000          0.01221760         -0.00473540          0.00092120
        272.74000000          0.06104900         -0.02426430          0.00482730
        102.68000000          0.20080390         -0.08309000          0.01622720
         42.14800000          0.40389420         -0.18002470          0.03663540
         18.14900000          0.39700270         -0.16632950          0.03078670
          7.59340000          0.11054810          0.21937170         -0.04806430
          3.19640000          0.00007680          0.58202390         -0.15598040
          1.27430000          0.00212630          0.34777200         -0.06323700
          0.28258000         -0.00037440          0.01924550          0.50408190
  1  1  1  1  1
          0.08409000          1.00000000
  1  2  2  5  1
         74.76200000          0.02576840
         21.30200000          0.14544210
          7.34360000          0.37137210
          2.56510000          0.48000020
          0.81970000          0.28968000
  1  2  2  1  1
          0.24700000          1.00000000
  1  0  0  1  1
          0.03396100          1.00000000
  1  1  1  1  1
          0.02394500          1.00000000
  1  2  2  1  1
          0.07710000          1.00000000
# ARSENIC     (14s,11p,6d) -> [5s,4p,2d]
# ARSENIC     Diffuse (1s,1p,1d)
AS aug-cc-pVDZ
  9
  1  0  0 13  4
     559583.79000000          0.00020240         -0.00006340          0.00002460         -0.00000680
      83879.33000000          0.00157090         -0.00048830          0.00019070         -0.00005250
      19092.66800000          0.00816620         -0.00258210          0.00100310         -0.00027560
       5407.39250000          0.03333990         -0.01054020          0.00413530         -0.00113890
       1763.75590000          0.10917260         -0.03693250          0.01442590         -0.00396460
        636.45672000          0.27188530         -0.10023550          0.04029620         -0.01114230
        248.08843000          0.42085090         -0.21429480          0.08756700         -0.02419910
        101.57851000          0.27922570         -0.18105260          0.08351780         -0.02363390
         31.47551300          0.03003010          0.47254100         -0.29329350          0.08663170
         13.43728200         -0.00688040          0.63861940         -0.54705200          0.16858390
          4.00869000          0.00242400          0.07581070          0.54387380         -0.20914250
          1.68492900         -0.00114910         -0.01352780          0.71435910         -0.45009180
          0.30001900          0.00030950          0.00319700          0.03534430          0.66039780
  1  0  0  1  1
          0.11358700          1.00000000
  1  1  1 10  3
       3886.35640000          0.00140970         -0.00055190          0.00012360
        921.20201000          0.01182770         -0.00465500          0.00102400
        297.19319000          0.05932800         -0.02391760          0.00538050
        111.97508000          0.19651150         -0.08256270          0.01824430
         46.03462100          0.39978910         -0.18067910          0.04159790
         19.87419400          0.40046530         -0.17248480          0.03629980
          8.38608800          0.11641960          0.20867000         -0.05235690
          3.55872800          0.00069180          0.58236220         -0.17916670
          1.44728200          0.00216330          0.35374650         -0.07404770
          0.34777900         -0.00041500          0.02064390          0.53580940
  1  1  1  1  1
          0.10769900          1.00000000
  1  2  2  5  1
         84.42423400          0.02452880
         24.18158900          0.14113400
          8.40177700          0.36875790
          2.98050200          0.48406260
          0.97900300          0.28244340
  1  2  2  1  1
          0.30980000          1.00000000
  1  0  0  1  1
          0.04115200          1.00000000
  1  1  1  1  1
          0.03126800          1.00000000
  1  2  2  1  1
          0.10780000          1.00000000
# SELENIUM    (14s,11p,6d) -> [5s,4p,2d]
# SELENIUM    Diffuse (1s,1p,1d)
SE aug-cc-pVDZ
  9
  1  0  0 13  4
     598990.00000000          0.00020040         -0.00006290          0.00002470         -0.00000720
      89783.00000000          0.00155540         -0.00048500          0.00019130         -0.00005590
      20435.00000000          0.00808720         -0.00256440          0.00100680         -0.00029380
       5786.90000000          0.03303440         -0.01047610          0.00415140         -0.00121360
       1887.30000000          0.10829240         -0.03672230          0.01449910         -0.00423400
        680.97000000          0.27033610         -0.09992250          0.04056580         -0.01190350
        265.39000000          0.42062360         -0.21419730          0.08853640         -0.02602060
        108.63000000          0.28159220         -0.18365930          0.08542120         -0.02561480
         33.76000000          0.03081100          0.46754540         -0.29325810          0.09194270
         14.46500000         -0.00716170          0.64147400         -0.55707270          0.18387000
          4.38900000          0.00260220          0.07925690          0.52614360         -0.21884610
          1.87830000         -0.00125830         -0.01426970          0.73203710         -0.48965240
          0.35859000          0.00034650          0.00337920          0.03882460          0.67758180
  1  0  0  1  1
          0.13649000          1.00000000
  1  1  1 10  3
       4135.60000000          0.00141270         -0.00056100          0.00013660
        980.34000000          0.01185880         -0.00473400          0.00113080
        316.35000000          0.05951530         -0.02435040          0.00595810
        119.25000000          0.19722010         -0.08410710          0.02018660
         49.06800000          0.40074390         -0.18413840          0.04619390
         21.21200000          0.39947400         -0.17350040          0.03940500
          8.94620000          0.11533640          0.21672630         -0.05928460
          3.82360000          0.00022190          0.58500990         -0.20146630
          1.58830000          0.00228380          0.34168160         -0.06878210
          0.40969000         -0.00047560          0.01991250          0.55959440
  1  1  1  1  1
          0.12459000          1.00000000
  1  2  2  5  1
         94.47200000          0.02349820
         27.18000000          0.13751830
          9.50680000          0.36648240
          3.41680000          0.48747170
          1.14790000          0.27657690
  1  2  2  1  1
          0.36820000          1.00000000
  1  0  0  1  1
          0.04874700          1.00000000
  1  1  1  1  1
          0.03549200          1.00000000
  1  2  2  1  1
          0.12830000          1.00000000
# BROMINE     (14s,11p,6d) -> [5s,4p,2d]
# BROMINE     Diffuse (1s,1p,1d)
BR aug-cc-pVDZ
  9
  1  0  0 13  4
     640100.00000000          0.00019840         -0.00006250          0.00002480         -0.00000760
      95938.00000000          0.00154000         -0.00048160          0.00019190         -0.00005880
      21833.00000000          0.00800960         -0.00254660          0.00101000         -0.00030920
       6181.90000000          0.03273410         -0.01041120          0.00416590         -0.00127660
       2015.70000000          0.10744800         -0.03651790          0.01456830         -0.00446340
        727.10000000          0.26889460         -0.09962950          0.04083450         -0.01255750
        283.28000000          0.42044110         -0.21413100          0.08948590         -0.02761450
        115.91000000          0.28380410         -0.18609110          0.08727860         -0.02739450
         36.12400000          0.03154550          0.46282610         -0.29336440          0.09640940
         15.53200000         -0.00742680          0.64411410         -0.56671090          0.19768710
          4.78570000          0.00277280          0.08255020          0.51056580         -0.22666930
          2.08170000         -0.00136350         -0.01496940          0.74772140         -0.52411650
          0.42028000          0.00038120          0.00352880          0.04215120          0.68898650
  1  0  0  1  1
          0.16069000          1.00000000
  1  1  1 10  3
       4340.80000000          0.00144480         -0.00058190          0.00015180
       1028.90000000          0.01212880         -0.00490650          0.00125630
        332.02000000          0.06080770         -0.02525140          0.00662240
        125.16000000          0.20093580         -0.08694450          0.02238160
         51.51100000          0.40474190         -0.18934220          0.05097170
         22.28100000          0.39571510         -0.17108820          0.04140090
          9.34170000          0.11022130          0.23687550         -0.07039700
          4.01320000         -0.00090900          0.58984000         -0.22325400
          1.70020000          0.00248320          0.31719440         -0.05641790
          0.47194000         -0.00057440          0.01798330          0.58080790
  1  1  1  1  1
          0.14421000          1.00000000
  1  2  2  5  1
        104.83000000          0.02265830
         30.27200000          0.13458950
         10.64900000          0.36471810
          3.86960000          0.49041960
          1.32390000          0.27138850
  1  2  2  1  1
          0.40980000          1.00000000
  1  0  0  1  1
          0.05694600          1.00000000
  1  1  1  1  1
          0.04104900          1.00000000
  1  2  2  1  1
          0.17190000          1.00000000
# KRYPTON     (14s,11p,6d) -> [5s,4p,2d]
# KRYPTON     Diffuse (1s,1p,1d)
KR aug-cc-pVDZ
  9
  1  0  0 13  4
     681358.82000000          0.00019690         -0.00006220          0.00002490         -0.00000790
     102126.48000000          0.00152860         -0.00047940          0.00019280         -0.00006140
      23243.71000000          0.00795000         -0.00253410          0.00101490         -0.00032300
       6582.00730000          0.03249380         -0.01036360          0.00418570         -0.00133300
       2146.42860000          0.10672400         -0.03635160          0.01464590         -0.00466720
        774.33782000          0.26757010         -0.09937370          0.04110700         -0.01313520
        301.67020000          0.42018510         -0.21406100          0.09039550         -0.02903420
        123.41184000          0.28580150         -0.18831920          0.08906230         -0.02901730
         38.56755100          0.03224610          0.45838160         -0.29357180          0.10026640
         16.63737900         -0.00768280          0.64656640         -0.57596980          0.21038180
          5.19879500          0.00293930          0.08565790          0.49685780         -0.23324710
          2.29481400         -0.00146620         -0.01561230          0.76168950         -0.55464970
          0.48521100          0.00041440          0.00364900          0.04532670          0.69695220
  1  0  0  1  1
          0.18627000          1.00000000
  1  1  1 10  3
       4474.26990000          0.00151950         -0.00062080          0.00017010
       1060.57900000          0.01274240         -0.00522120          0.00140640
        342.20812000          0.06364650         -0.02684630          0.00739630
        128.99842000          0.20856350         -0.09158230          0.02482540
         53.08722200          0.41224230         -0.19681640          0.05571550
         22.95942500          0.38781030         -0.16347500          0.04121320
          9.50730000          0.10038200          0.27382040         -0.08760570
          4.08305500         -0.00250780          0.59815920         -0.24405860
          1.75044600          0.00271390          0.27504530         -0.02950070
          0.52919000         -0.00069770          0.01277060          0.60122950
  1  1  1  1  1
          0.16436900          1.00000000
  1  2  2  5  1
        115.52532000          0.02195570
         33.46524600          0.13216200
         11.83045900          0.36334840
          4.33977100          0.49295820
          1.50752400          0.26675600
  1  2  2  1  1
          0.50300000          1.00000000
  1  0  0  1  1
          0.06514500          1.00000000
  1  1  1  1  1
          0.04660600          1.00000000
  1  2  2  1  1
          0.21550000          1.00000000
# BASIS="aug-cc-pVTZ"
#Elements                             References
#--------                             ----------
# H     : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He    : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
#Li - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#Na - Mg: D.E. Woon and T.H. Dunning, Jr.  (to be published)
#Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
#Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#Elements                             References
#--------                             ---------
# H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
# B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#         6769 (1992).
#Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN    (5s,2p,1d) -> [3s,2p,1d]
# HYDROGEN    Diffuse (1s,1p,1d)
H  aug-cc-pVTZ
  9
  1  0  0  3  1
         33.87000000          0.00606800
          5.09500000          0.04530800
          1.15900000          0.20282200
  1  0  0  1  1
          0.32580000          1.00000000
  1  0  0  1  1
          0.10270000          1.00000000
  1  1  1  1  1
          1.40700000          1.00000000
  1  1  1  1  1
          0.38800000          1.00000000
  1  2  2  1  1
          1.05700000          1.00000000
  1  0  0  1  1
          0.02526000          1.00000000
  1  1  1  1  1
          0.10200000          1.00000000
  1  2  2  1  1
          0.24700000          1.00000000
# HELIUM      (6s,2p,1d) -> [3s,2p,1d]
# HELIUM      Diffuse (1s,1p,1d)
HE aug-cc-pVTZ
  9
  1  0  0  4  1
        234.00000000          0.00258700
         35.16000000          0.01953300
          7.98900000          0.09099800
          2.21200000          0.27205000
  1  0  0  1  1
          0.66690000          1.00000000
  1  0  0  1  1
          0.20890000          1.00000000
  1  1  1  1  1
          3.04400000          1.00000000
  1  1  1  1  1
          0.75800000          1.00000000
  1  2  2  1  1
          1.96500000          1.00000000
  1  0  0  1  1
          0.05138000          1.00000000
  1  1  1  1  1
          0.19930000          1.00000000
  1  2  2  1  1
          0.45920000          1.00000000
# BORON       (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# BORON       Diffuse (1s,1p,1d,1f)
B  aug-cc-pVTZ
 13
  1  0  0  8  2
       5473.00000000          0.00055500         -0.00011200
        820.90000000          0.00429100         -0.00086800
        186.80000000          0.02194900         -0.00448400
         52.83000000          0.08444100         -0.01768300
         17.08000000          0.23855700         -0.05363900
          5.99900000          0.43507200         -0.11900500
          2.20800000          0.34195500         -0.16582400
          0.24150000         -0.00954500          0.59598100
  1  0  0  1  1
          0.58790000          1.00000000
  1  0  0  1  1
          0.08610000          1.00000000
  1  1  1  3  1
         12.05000000          0.01311800
          2.61300000          0.07989600
          0.74750000          0.27727500
  1  1  1  1  1
          0.23850000          1.00000000
  1  1  1  1  1
          0.07698000          1.00000000
  1  2  2  1  1
          0.66100000          1.00000000
  1  2  2  1  1
          0.19900000          1.00000000
  1  3  3  1  1
          0.49000000          1.00000000
  1  0  0  1  1
          0.02914000          1.00000000
  1  1  1  1  1
          0.02096000          1.00000000
  1  2  2  1  1
          0.06040000          1.00000000
  1  3  3  1  1
          0.16300000          1.00000000
# CARBON      (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# CARBON      Diffuse (1s,1p,1d,1f)
C  aug-cc-pVTZ
 13
  1  0  0  8  2
       8236.00000000          0.00053100         -0.00011300
       1235.00000000          0.00410800         -0.00087800
        280.80000000          0.02108700         -0.00454000
         79.27000000          0.08185300         -0.01813300
         25.59000000          0.23481700         -0.05576000
          8.99700000          0.43440100         -0.12689500
          3.31900000          0.34612900         -0.17035200
          0.36430000         -0.00898300          0.59868400
  1  0  0  1  1
          0.90590000          1.00000000
  1  0  0  1  1
          0.12850000          1.00000000
  1  1  1  3  1
         18.71000000          0.01403100
          4.13300000          0.08686600
          1.20000000          0.29021600
  1  1  1  1  1
          0.38270000          1.00000000
  1  1  1  1  1
          0.12090000          1.00000000
  1  2  2  1  1
          1.09700000          1.00000000
  1  2  2  1  1
          0.31800000          1.00000000
  1  3  3  1  1
          0.76100000          1.00000000
  1  0  0  1  1
          0.04402000          1.00000000
  1  1  1  1  1
          0.03569000          1.00000000
  1  2  2  1  1
          0.10000000          1.00000000
  1  3  3  1  1
          0.26800000          1.00000000
# NITROGEN    (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# NITROGEN    Diffuse (1s,1p,1d,1f)
N  aug-cc-pVTZ
 13
  1  0  0  8  2
      11420.00000000          0.00052300         -0.00011500
       1712.00000000          0.00404500         -0.00089500
        389.30000000          0.02077500         -0.00462400
        110.00000000          0.08072700         -0.01852800
         35.57000000          0.23307400         -0.05733900
         12.54000000          0.43350100         -0.13207600
          4.64400000          0.34747200         -0.17251000
          0.51180000         -0.00850800          0.59994400
  1  0  0  1  1
          1.29300000          1.00000000
  1  0  0  1  1
          0.17870000          1.00000000
  1  1  1  3  1
         26.63000000          0.01467000
          5.94800000          0.09176400
          1.74200000          0.29868300
  1  1  1  1  1
          0.55500000          1.00000000
  1  1  1  1  1
          0.17250000          1.00000000
  1  2  2  1  1
          1.65400000          1.00000000
  1  2  2  1  1
          0.46900000          1.00000000
  1  3  3  1  1
          1.09300000          1.00000000
  1  0  0  1  1
          0.05760000          1.00000000
  1  1  1  1  1
          0.04910000          1.00000000
  1  2  2  1  1
          0.15100000          1.00000000
  1  3  3  1  1
          0.36400000          1.00000000
# OXYGEN      (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# OXYGEN      Diffuse (1s,1p,1d,1f)
O  aug-cc-pVTZ
 13
  1  0  0  8  2
      15330.00000000          0.00050800         -0.00011500
       2299.00000000          0.00392900         -0.00089500
        522.40000000          0.02024300         -0.00463600
        147.30000000          0.07918100         -0.01872400
         47.55000000          0.23068700         -0.05846300
         16.76000000          0.43311800         -0.13646300
          6.20700000          0.35026000         -0.17574000
          0.68820000         -0.00815400          0.60341800
  1  0  0  1  1
          1.75200000          1.00000000
  1  0  0  1  1
          0.23840000          1.00000000
  1  1  1  3  1
         34.46000000          0.01592800
          7.74900000          0.09974000
          2.28000000          0.31049200
  1  1  1  1  1
          0.71560000          1.00000000
  1  1  1  1  1
          0.21400000          1.00000000
  1  2  2  1  1
          2.31400000          1.00000000
  1  2  2  1  1
          0.64500000          1.00000000
  1  3  3  1  1
          1.42800000          1.00000000
  1  0  0  1  1
          0.07376000          1.00000000
  1  1  1  1  1
          0.05974000          1.00000000
  1  2  2  1  1
          0.21400000          1.00000000
  1  3  3  1  1
          0.50000000          1.00000000
# FLUORINE    (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# FLUORINE    Diffuse (1s,1p,1d,1f)
F  aug-cc-pVTZ
 13
  1  0  0  8  2
      19500.00000000          0.00050700         -0.00011700
       2923.00000000          0.00392300         -0.00091200
        664.50000000          0.02020000         -0.00471700
        187.50000000          0.07901000         -0.01908600
         60.62000000          0.23043900         -0.05965500
         21.42000000          0.43287200         -0.14001000
          7.95000000          0.34996400         -0.17678200
          0.88150000         -0.00789200          0.60504300
  1  0  0  1  1
          2.25700000          1.00000000
  1  0  0  1  1
          0.30410000          1.00000000
  1  1  1  3  1
         43.88000000          0.01666500
          9.92600000          0.10447200
          2.93000000          0.31726000
  1  1  1  1  1
          0.91320000          1.00000000
  1  1  1  1  1
          0.26720000          1.00000000
  1  2  2  1  1
          3.10700000          1.00000000
  1  2  2  1  1
          0.85500000          1.00000000
  1  3  3  1  1
          1.91700000          1.00000000
  1  0  0  1  1
          0.09158000          1.00000000
  1  1  1  1  1
          0.07361000          1.00000000
  1  2  2  1  1
          0.29200000          1.00000000
  1  3  3  1  1
          0.72400000          1.00000000
# NEON        (10s,5p,2d,1f) -> [4s,3p,2d,1f]
# NEON        Diffuse (1s,1p,1d,1f)
NE aug-cc-pVTZ
 13
  1  0  0  8  2
      24350.00000000          0.00050200         -0.00011800
       3650.00000000          0.00388100         -0.00091500
        829.60000000          0.01999700         -0.00473700
        234.00000000          0.07841800         -0.01923300
         75.61000000          0.22967600         -0.06036900
         26.73000000          0.43272200         -0.14250800
          9.92700000          0.35064200         -0.17771000
          1.10200000         -0.00764500          0.60583600
  1  0  0  1  1
          2.83600000          1.00000000
  1  0  0  1  1
          0.37820000          1.00000000
  1  1  1  3  1
         54.70000000          0.01715100
         12.43000000          0.10765600
          3.67900000          0.32168100
  1  1  1  1  1
          1.14300000          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  2  2  1  1
          4.01400000          1.00000000
  1  2  2  1  1
          1.09600000          1.00000000
  1  3  3  1  1
          2.54400000          1.00000000
  1  0  0  1  1
          0.11330000          1.00000000
  1  1  1  1  1
          0.09175000          1.00000000
  1  2  2  1  1
          0.38600000          1.00000000
  1  3  3  1  1
          1.08400000          1.00000000
# ALUMINUM    (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# ALUMINUM    Diffuse (1s,1p,1d,1f)
AL aug-cc-pVTZ
 13
  1  0  0 13  3
     205500.00000000          0.00006788         -0.00001764          0.00000407
      30780.00000000          0.00052715         -0.00013720          0.00003166
       7006.00000000          0.00276203         -0.00071891          0.00016612
       1985.00000000          0.01147280         -0.00301146          0.00069499
        649.10000000          0.03981880         -0.01060140          0.00245511
        235.00000000          0.11504000         -0.03213450          0.00744598
         91.62000000          0.26088700         -0.08031560          0.01882530
         37.67000000          0.39638600         -0.15679400          0.03727720
         15.91000000          0.28459700         -0.16837600          0.04194960
          5.85000000          0.04445830          0.12687900         -0.03543750
          2.54200000         -0.00489838          0.56149400         -0.17513200
          1.05700000          0.00261253          0.43661300         -0.27620300
          0.14550000          0.00072207         -0.01145630          0.65280900
  1  0  0  1  1
          0.29310000          1.00000000
  1  0  0  1  1
          0.05650000          1.00000000
  1  1  1  7  2
        444.40000000          0.00162786         -0.00028634
        105.10000000          0.01306870         -0.00242308
         33.47000000          0.06123410         -0.01086580
         12.33000000          0.18787000         -0.03643070
          4.86900000          0.36045200         -0.06410740
          1.96100000          0.40845400         -0.09722390
          0.18880000          0.00976514          0.50344800
  1  1  1  1  1
          0.78340000          1.00000000
  1  1  1  1  1
          0.05557000          1.00000000
  1  2  2  1  1
          0.10900000          1.00000000
  1  2  2  1  1
          0.33300000          1.00000000
  1  3  3  1  1
          0.24400000          1.00000000
  1  0  0  1  1
          0.02210000          1.00000000
  1  1  1  1  1
          0.01460000          1.00000000
  1  2  2  1  1
          0.03560000          1.00000000
  1  3  3  1  1
          0.08580000          1.00000000
# SILICON     (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# SILICON     Diffuse (1s,1p,1d,1f)
SI aug-cc-pVTZ
 13
  1  0  0 13  3
     254900.00000000          0.00006251         -0.00001664          0.00000426
      38190.00000000          0.00048555         -0.00012931          0.00003311
       8690.00000000          0.00254516         -0.00067883          0.00017402
       2462.00000000          0.01058660         -0.00284117          0.00072757
        804.80000000          0.03687870         -0.01005510          0.00258333
        291.30000000          0.10747900         -0.03057740          0.00786354
        113.60000000          0.24793600         -0.07772560          0.02021550
         46.75000000          0.39092700         -0.15423600          0.04073200
         19.82000000          0.30202600         -0.18036800          0.04993580
          7.70800000          0.05592360          0.07982180         -0.02493960
          3.34000000         -0.00402406          0.54744100         -0.19035000
          1.40200000          0.00258030          0.48011900         -0.31835000
          0.20700000          0.00060793         -0.01069960          0.68118000
  1  0  0  1  1
          0.43870000          1.00000000
  1  0  0  1  1
          0.07944000          1.00000000
  1  1  1  7  2
        481.50000000          0.00192045         -0.00040522
        113.90000000          0.01535520         -0.00335896
         36.23000000          0.07139910         -0.01528600
         13.34000000          0.21305200         -0.04892180
          5.25200000          0.39035400         -0.08550080
          2.12000000          0.39372100         -0.11213700
          0.25280000          0.00395630          0.55191900
  1  1  1  1  1
          0.85610000          1.00000000
  1  1  1  1  1
          0.07889000          1.00000000
  1  2  2  1  1
          0.15900000          1.00000000
  1  2  2  1  1
          0.48100000          1.00000000
  1  3  3  1  1
          0.33600000          1.00000000
  1  0  0  1  1
          0.03300000          1.00000000
  1  1  1  1  1
          0.02370000          1.00000000
  1  2  2  1  1
          0.05560000          1.00000000
  1  3  3  1  1
          0.12500000          1.00000000
# PHOSPHORUS  (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# PHOSPHORUS  Diffuse (1s,1p,1d,1f)
P  aug-cc-pVTZ
 13
  1  0  0 13  3
     312400.00000000          0.00005770         -0.00001567          0.00000431
      46800.00000000          0.00044830         -0.00012172          0.00003342
      10650.00000000          0.00234939         -0.00063967          0.00017589
       3018.00000000          0.00978265         -0.00267426          0.00073434
        986.80000000          0.03414670         -0.00949831          0.00261775
        357.40000000          0.10020400         -0.02893490          0.00797852
        139.60000000          0.23437200         -0.07451210          0.02079400
         57.63000000          0.38243400         -0.14993800          0.04244460
         24.60000000          0.31808800         -0.18946700          0.05634360
         10.12000000          0.07077880          0.03632700         -0.01273580
          4.28300000         -0.00181799          0.52881600         -0.19649500
          1.80500000          0.00216180          0.51911500         -0.35355500
          0.27820000          0.00043230         -0.00925695          0.70091200
  1  0  0  1  1
          0.61580000          1.00000000
  1  0  0  1  1
          0.10550000          1.00000000
  1  1  1  7  2
        504.90000000          0.00233728         -0.00055524
        119.40000000          0.01854100         -0.00445913
         37.96000000          0.08496930         -0.02063500
         13.95000000          0.24461500         -0.06176940
          5.45700000          0.42276600         -0.10892400
          2.17700000          0.36843900         -0.10559900
          0.28770000         -0.00379005          0.57698100
  1  1  1  1  1
          0.80100000          1.00000000
  1  1  1  1  1
          0.09714000          1.00000000
  1  2  2  1  1
          0.21600000          1.00000000
  1  2  2  1  1
          0.65200000          1.00000000
  1  3  3  1  1
          0.45200000          1.00000000
  1  0  0  1  1
          0.04090000          1.00000000
  1  1  1  1  1
          0.03070000          1.00000000
  1  2  2  1  1
          0.07750000          1.00000000
  1  3  3  1  1
          0.16500000          1.00000000
# SULFUR      (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# SULFUR      Diffuse (1s,1p,1d,1f)
S  aug-cc-pVTZ
 13
  1  0  0 13  3
     374100.00000000          0.00005421         -0.00001498          0.00000435
      56050.00000000          0.00042086         -0.00011620          0.00003371
      12760.00000000          0.00220698         -0.00061158          0.00017767
       3615.00000000          0.00919258         -0.00255370          0.00074112
       1183.00000000          0.03211230         -0.00908708          0.00264591
        428.80000000          0.09466830         -0.02770450          0.00807487
        167.80000000          0.22363000         -0.07200200          0.02122760
         69.47000000          0.37439300         -0.14643900          0.04383230
         29.84000000          0.32910800         -0.19515000          0.06127160
         12.72000000          0.08470380          0.00819193         -0.00361510
          5.24400000          0.00044085          0.51660100         -0.20451000
          2.21900000          0.00164827          0.54217800         -0.38187100
          0.34900000          0.00030131         -0.00918072          0.71414700
  1  0  0  1  1
          0.77670000          1.00000000
  1  0  0  1  1
          0.13220000          1.00000000
  1  1  1  7  2
        574.40000000          0.00242264         -0.00062010
        135.80000000          0.01927960         -0.00493882
         43.19000000          0.08854010         -0.02326470
         15.87000000          0.25465400         -0.06851950
          6.20800000          0.43398400         -0.12389600
          2.48300000          0.35495300         -0.09694990
          0.32290000         -0.00502977          0.56939400
  1  1  1  1  1
          0.86880000          1.00000000
  1  1  1  1  1
          0.10980000          1.00000000
  1  2  2  1  1
          0.26900000          1.00000000
  1  2  2  1  1
          0.81900000          1.00000000
  1  3  3  1  1
          0.55700000          1.00000000
  1  0  0  1  1
          0.04970000          1.00000000
  1  1  1  1  1
          0.03510000          1.00000000
  1  2  2  1  1
          0.10100000          1.00000000
  1  3  3  1  1
          0.21800000          1.00000000
# CHLORINE    (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# CHLORINE    Diffuse (1s,1p,1d,1f)
CL aug-cc-pVTZ
 13
  1  0  0 13  3
     456100.00000000          0.00004930         -0.00001383          0.00000419
      68330.00000000          0.00038303         -0.00010728          0.00003244
      15550.00000000          0.00200854         -0.00056508          0.00017111
       4405.00000000          0.00838558         -0.00236135          0.00071418
       1439.00000000          0.02947030         -0.00845886          0.00256705
        520.40000000          0.08783250         -0.02596380          0.00788552
        203.10000000          0.21147300         -0.06863620          0.02108670
         83.96000000          0.36536400         -0.14187400          0.04422640
         36.20000000          0.34088400         -0.19931900          0.06516700
         15.83000000          0.10213300         -0.01956620          0.00603012
          6.33400000          0.00311675          0.49974100         -0.20649500
          2.69400000          0.00105751          0.56373600         -0.40587100
          0.43130000          0.00015614         -0.00835091          0.72566100
  1  0  0  1  1
          0.97680000          1.00000000
  1  0  0  1  1
          0.16250000          1.00000000
  1  1  1  7  2
        663.30000000          0.00240448         -0.00065215
        156.80000000          0.01921480         -0.00519445
         49.98000000          0.08850970         -0.02469380
         18.42000000          0.25602000         -0.07281670
          7.24000000          0.43692700         -0.13403000
          2.92200000          0.35033400         -0.09477420
          0.38180000         -0.00458423          0.56466700
  1  1  1  1  1
          1.02200000          1.00000000
  1  1  1  1  1
          0.13010000          1.00000000
  1  2  2  1  1
          1.04600000          1.00000000
  1  2  2  1  1
          0.34400000          1.00000000
  1  3  3  1  1
          0.70600000          1.00000000
  1  0  0  1  1
          0.05910000          1.00000000
  1  1  1  1  1
          0.04190000          1.00000000
  1  2  2  1  1
          0.13500000          1.00000000
  1  3  3  1  1
          0.31200000          1.00000000
# ARGON       (15s,9p,2d,1f) -> [5s,4p,2d,1f]
# ARGON       Diffuse (1s,1p,1d,1f)
AR aug-cc-pVTZ
 13
  1  0  0 13  3
     545000.00000000          0.00004558         -0.00001296          0.00000405
      81640.00000000          0.00035411         -0.00010043          0.00003137
      18580.00000000          0.00185797         -0.00052958          0.00016565
       5261.00000000          0.00776851         -0.00221396          0.00069166
       1717.00000000          0.02742320         -0.00796845          0.00249790
        619.90000000          0.08238360         -0.02458030          0.00771074
        241.60000000          0.20123000         -0.06577980          0.02087140
         99.79000000          0.35678100         -0.13794200          0.04439650
         43.15000000          0.34956300         -0.20163000          0.06802240
         19.14000000          0.11826600         -0.04128340          0.01413500
          7.48800000          0.00560190          0.48468000         -0.20748900
          3.20500000          0.00048347          0.57922400         -0.42504500
          0.52040000          0.00002920         -0.00727553          0.73362700
  1  0  0  1  1
          1.19600000          1.00000000
  1  0  0  1  1
          0.19540000          1.00000000
  1  1  1  7  2
        761.80000000          0.00236976         -0.00066721
        180.20000000          0.01901990         -0.00532717
         57.50000000          0.08808070         -0.02554940
         21.24000000          0.25637700         -0.07571970
          8.38800000          0.43871100         -0.14113300
          3.41600000          0.34756900         -0.09327680
          0.45230000         -0.00523882          0.56245000
  1  1  1  1  1
          1.20600000          1.00000000
  1  1  1  1  1
          0.15450000          1.00000000
  1  2  2  1  1
          0.41000000          1.00000000
  1  2  2  1  1
          1.25400000          1.00000000
  1  3  3  1  1
          0.89000000          1.00000000
  1  0  0  1  1
          0.06850000          1.00000000
  1  1  1  1  1
          0.04870000          1.00000000
  1  2  2  1  1
          0.16900000          1.00000000
  1  3  3  1  1
          0.40600000          1.00000000
# GALLIUM     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# GALLIUM     Diffuse (1s,1p,1d,1f)
GA aug-cc-pVTZ
 14
  1  0  0 18  4
    6558157.30000000          0.00000800         -0.00000250          0.00000000          0.00000000
     982025.34000000          0.00006220         -0.00001930          0.00000740          0.00000170
     223467.69000000          0.00032700         -0.00010140          0.00003870          0.00000900
      63288.29100000          0.00137940         -0.00042810          0.00016330          0.00003800
      20642.94000000          0.00499930         -0.00155820          0.00059440          0.00013820
       7450.52240000          0.01606050         -0.00504690          0.00192920          0.00044890
       2905.07440000          0.04601240         -0.01480560          0.00566890          0.00131880
       1204.21000000          0.11522240         -0.03894820          0.01502820          0.00350160
        524.30454000          0.23739210         -0.08968320          0.03502220          0.00816730
        237.46563000          0.35319890         -0.16640760          0.06711350          0.01573380
        110.57866000          0.29155000         -0.20040100          0.08501560          0.02002840
         51.37462400          0.08121290          0.01149430         -0.00472120         -0.00101360
         24.44084600          0.00076550          0.49581340         -0.30167370         -0.07501620
         11.76859100          0.00161240          0.52955500         -0.48254890         -0.12579800
          5.34211900         -0.00075300          0.11101850          0.08916950          0.03008570
          2.49503600          0.00031340         -0.00070000          0.72878300          0.24881690
          1.09877300         -0.00013060          0.00222830          0.42885420          0.28437060
          0.26018000          0.00005130         -0.00050140          0.02072490         -0.31105940
  1  0  0  1  1
          0.12707900          1.00000000
  1  0  0  1  1
          0.05440800          1.00000000
  1  1  1 11  3
       8050.16740000          0.00031690         -0.00012030          0.00002000
       1907.53610000          0.00276480         -0.00104920          0.00016890
        618.62746000          0.01512040         -0.00581020          0.00096680
        235.32417000          0.05995830         -0.02343450          0.00377970
         98.89964600          0.17331200         -0.07082700          0.01190820
         44.24821500          0.34108200         -0.14655110          0.02356930
         20.61742900          0.38969670         -0.17696600          0.03142330
          9.78051600          0.18398170          0.03638210         -0.01361880
          4.44123800          0.02188960          0.42328480         -0.07340030
          1.96404500          0.00116080          0.49525860         -0.12647850
          0.83357800          0.00027350          0.17974280          0.01585790
  1  1  1  1  1
          0.19344500          1.00000000
  1  1  1  1  1
          0.05611700          1.00000000
  1  2  2  7  1
        244.14741000          0.00202700
         73.06759500          0.01650880
         27.59208100          0.07038230
         11.54651800          0.19114300
          5.04862800          0.32540920
          2.17846500          0.36781990
          0.90025300          0.27446850
  1  2  2  1  1
          0.33732700          1.00000000
  1  2  2  1  1
          0.11690000          1.00000000
  1  3  3  1  1
          0.28810000          1.00000000
  1  0  0  1  1
          0.01439800          1.00000000
  1  1  1  1  1
          0.01930000          1.00000000
  1  2  2  1  1
          0.03870000          1.00000000
  1  3  3  1  1
          0.09800000          1.00000000
# GERMANIUM   (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# GERMANIUM   Diffuse (1s,1p,1d,1f)
GE aug-cc-pVTZ
 14
  1  0  0 18  4
    7447966.80000000          0.00000740         -0.00000230          0.00000000          0.00000000
    1115318.20000000          0.00005740         -0.00001790          0.00000690         -0.00000180
     253842.65000000          0.00030190         -0.00009400          0.00003620         -0.00000930
      71915.28500000          0.00127330         -0.00039640          0.00015280         -0.00003920
      23470.18100000          0.00461230         -0.00144250          0.00055630         -0.00014260
       8477.49180000          0.01482140         -0.00466750          0.00180180         -0.00046210
       3308.39080000          0.04255360         -0.01371530          0.00530850         -0.00136140
       1372.60540000          0.10730550         -0.03617970          0.01408770         -0.00361750
        598.22007000          0.22451780         -0.08416790          0.03320130         -0.00853590
        271.38602000          0.34531310         -0.15887670          0.06446210         -0.01665060
        126.97795000          0.30452610         -0.20338070          0.08695400         -0.02259110
         60.22206500          0.09906700         -0.02514100          0.01187450         -0.00321470
         28.01858200          0.00413170          0.45751520         -0.27245340          0.07449980
         13.51752200          0.00103470          0.55719390         -0.50014520          0.14403330
          6.30940600         -0.00048560          0.13970550          0.01085540         -0.00808150
          2.90453400          0.00018050          0.00226450          0.72164690         -0.27041630
          1.28755600         -0.00009120          0.00209270          0.48052130         -0.34016070
          0.16773200         -0.00002660          0.00032810         -0.01022970          0.61906570
  1  0  0  1  1
          0.33655200          1.00000000
  1  0  0  1  1
          0.07106900          1.00000000
  1  1  1 11  3
       6979.59820000          0.00045690         -0.00017560          0.00003480
       1654.16480000          0.00395620         -0.00153050          0.00030140
        536.02865000          0.02131430         -0.00831450          0.00164870
        203.53713000          0.08187150         -0.03287180          0.00649820
         85.23753000          0.22237320         -0.09316610          0.01863830
         37.84196200          0.39056590         -0.17555420          0.03506130
         17.40651200          0.35604150         -0.14679120          0.02958920
          7.88149200          0.10703120          0.18629340         -0.04724580
          3.53321300          0.00369410          0.52648620         -0.12498470
          1.52147300          0.00192190          0.39708590         -0.12108010
          0.19909300          0.00019170         -0.00334780          0.57547300
  1  1  1  1  1
          0.56270400          1.00000000
  1  1  1  1  1
          0.06703100          1.00000000
  1  2  2  7  1
        282.23911000          0.00182750
         84.54995700          0.01515450
         32.07365600          0.06604600
         13.49749500          0.18394700
          5.95855000          0.32278720
          2.61078800          0.37294590
          1.10398700          0.27517300
  1  2  2  1  1
          0.42404900          1.00000000
  1  2  2  1  1
          0.15200000          1.00000000
  1  3  3  1  1
          0.34580000          1.00000000
  1  0  0  1  1
          0.02737000          1.00000000
  1  1  1  1  1
          0.02136800          1.00000000
  1  2  2  1  1
          0.05280000          1.00000000
  1  3  3  1  1
          0.13230000          1.00000000
# ARSENIC     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# ARSENIC     Diffuse (1s,1p,1d,1f)
AS aug-cc-pVTZ
 14
  1  0  0 18  4
    8482339.60000000          0.00000680         -0.00000210          0.00000000          0.00000000
    1270150.90000000          0.00005280         -0.00001650          0.00000640         -0.00000180
     289056.96000000          0.00027740         -0.00008660          0.00003370         -0.00000930
      81879.84900000          0.00117020         -0.00036530          0.00014230         -0.00003920
      26716.56400000          0.00424210         -0.00133090          0.00051880         -0.00014290
       9647.58420000          0.01365570         -0.00430930          0.00168020         -0.00046290
       3764.11950000          0.03933990         -0.01269730          0.00496770         -0.00136870
       1561.56560000          0.09992920         -0.03361600          0.01321150         -0.00364400
        680.81467000          0.21215550         -0.07894700          0.03145660         -0.00868840
        309.24119000          0.33638660         -0.15144580          0.06184460         -0.01715560
        145.25736000          0.31551250         -0.20420140          0.08795660         -0.02455140
         69.73904800          0.11813120         -0.05573670          0.02575480         -0.00735240
         31.77032500          0.00800760          0.41876070         -0.24554590          0.07200870
         15.39175700          0.00032930          0.57587620         -0.50905720          0.15762540
          7.34152600         -0.00015230          0.16968420         -0.05557490          0.01420740
          3.32371600          0.00002470          0.00606620          0.70837960         -0.28515930
          1.48586700         -0.00003660          0.00176050          0.52310270         -0.38853470
          0.21150000         -0.00000940          0.00023160         -0.01111760          0.64953370
  1  0  0  1  1
          0.42108600          1.00000000
  1  0  0  1  1
          0.08897400          1.00000000
  1  1  1 11  3
       7423.86140000          0.00045990         -0.00017940          0.00003990
       1759.51660000          0.00398230         -0.00156410          0.00034880
        570.22916000          0.02146380         -0.00849990          0.00189530
        216.57997000          0.08246170         -0.03363270          0.00753250
         90.73425200          0.22389020         -0.09532280          0.02143150
         40.30879100          0.39207040         -0.17936260          0.04078070
         18.55550200          0.35422380         -0.14666820          0.03252490
          8.39654300          0.10486410          0.19660160         -0.05488320
          3.76736700          0.00336640          0.53720880         -0.15119220
          1.62970100          0.00184950          0.38573610         -0.12490110
          0.22250300          0.00022970         -0.00540060          0.58552930
  1  1  1  1  1
          0.56826300          1.00000000
  1  1  1  1  1
          0.08040500          1.00000000
  1  2  2  7  1
        321.01961000          0.00168400
         96.24930500          0.01415860
         36.64496300          0.06282590
         15.49396500          0.17849930
          6.89113800          0.32094520
          3.05483100          0.37735150
          1.31424100          0.27502310
  1  2  2  1  1
          0.51343000          1.00000000
  1  2  2  1  1
          0.18770000          1.00000000
  1  3  3  1  1
          0.41580000          1.00000000
  1  0  0  1  1
          0.03340700          1.00000000
  1  1  1  1  1
          0.02679900          1.00000000
  1  2  2  1  1
          0.07000000          1.00000000
  1  3  3  1  1
          0.16900000          1.00000000
# SELENIUM    (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# SELENIUM    Diffuse (1s,1p,1d,1f)
SE aug-cc-pVTZ
 14
  1  0  0 18  4
    9563600.00000000          0.00000630         -0.00000200          0.00000000          0.00000000
    1432100.00000000          0.00004890         -0.00001530          0.00000600         -0.00000180
     325910.00000000          0.00025740         -0.00008060          0.00003170         -0.00000930
      92312.00000000          0.00108610         -0.00034000          0.00013370         -0.00003910
      30116.00000000          0.00393990         -0.00123970          0.00048830         -0.00014280
      10872.00000000          0.01270410         -0.00401770          0.00158210         -0.00046270
       4240.10000000          0.03671560         -0.01186720          0.00469190         -0.00137220
       1758.40000000          0.09386720         -0.03153400          0.01250980         -0.00366280
        766.59000000          0.20176770         -0.07464390          0.03003810         -0.00880610
        348.43000000          0.32805400         -0.14521790          0.05972710         -0.01758670
        164.03000000          0.32383340         -0.20384410          0.08846960         -0.02620740
         79.14200000          0.13523370         -0.07887110          0.03639200         -0.01099640
         35.52400000          0.01170750          0.38458250         -0.22353290          0.06956970
         17.30500000         -0.00034360          0.58652700         -0.51224620          0.16839470
          8.37840000          0.00016650          0.19735910         -0.10842240          0.03461600
          3.74050000         -0.00011880          0.01001020          0.69363720         -0.29787020
          1.68900000          0.00002040          0.00131600          0.55587110         -0.43225690
          0.25520000          0.00000830          0.00011090         -0.01138320          0.67572170
  1  0  0  1  1
          0.50927000          1.00000000
  1  0  0  1  1
          0.10651000          1.00000000
  1  1  1 11  3
       8004.30000000          0.00045050         -0.00017830          0.00004300
       1896.90000000          0.00390490         -0.00155540          0.00037700
        614.71000000          0.02109010         -0.00847270          0.00204650
        233.50000000          0.08129200         -0.03362450          0.00818990
         97.85600000          0.22178410         -0.09582670          0.02333560
         43.51400000          0.39072700         -0.18139070          0.04498130
         20.06300000          0.35597140         -0.15031520          0.03574750
          9.11270000          0.10732720          0.19482630         -0.05868660
          4.10630000          0.00369850          0.54155540         -0.17095730
          1.79490000          0.00180320          0.38372990         -0.12935830
          0.24615000          0.00022080         -0.00501320          0.57780690
  1  1  1  1  1
          0.62432000          1.00000000
  1  1  1  1  1
          0.08891700          1.00000000
  1  2  2  7  1
        361.85000000          0.00156550
        108.55000000          0.01332620
         41.43300000          0.06015270
         17.57900000          0.17402930
          7.86270000          0.31956900
          3.51800000          0.38120290
          1.53480000          0.27460860
  1  2  2  1  1
          0.60813000          1.00000000
  1  2  2  1  1
          0.22200000          1.00000000
  1  3  3  1  1
          0.46200000          1.00000000
  1  0  0  1  1
          0.03920100          1.00000000
  1  1  1  1  1
          0.03025100          1.00000000
  1  2  2  1  1
          0.08370000          1.00000000
  1  3  3  1  1
          0.18800000          1.00000000
# BROMINE     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# BROMINE     Diffuse (1s,1p,1d,1f)
BR aug-cc-pVTZ
 14
  1  0  0 18  4
   10639000.00000000          0.00000590         -0.00000190          0.00000000          0.00000000
    1593400.00000000          0.00004610         -0.00001450          0.00000570         -0.00000180
     362610.00000000          0.00024220         -0.00007610          0.00003030         -0.00000930
     102700.00000000          0.00102260         -0.00032100          0.00012750         -0.00003910
      33501.00000000          0.00371130         -0.00117090          0.00046590         -0.00014280
      12093.00000000          0.01197850         -0.00379680          0.00150960         -0.00046280
       4715.90000000          0.03469270         -0.01123070          0.00448520         -0.00137500
       1955.60000000          0.08912390         -0.02992770          0.01198350         -0.00367840
        852.61000000          0.19345570         -0.07127060          0.02895710         -0.00889810
        387.67000000          0.32090190         -0.14031360          0.05815660         -0.01795290
        182.68000000          0.32992330         -0.20307630          0.08881330         -0.02757320
         88.24500000          0.14941210         -0.09609850          0.04452440         -0.01409530
         39.26300000          0.01499380          0.35580860         -0.20603870          0.06725610
         19.23400000         -0.00091650          0.59217920         -0.51270170          0.17669280
          9.40570000          0.00043800          0.22159770         -0.15093490          0.05288610
          4.16010000         -0.00023980          0.01376480          0.67892030         -0.30759550
          1.89950000          0.00007360          0.00083950          0.58176970         -0.47006580
          0.30114000          0.00002390         -0.00000850         -0.01118250          0.69803410
  1  0  0  1  1
          0.60472000          1.00000000
  1  0  0  1  1
          0.12515000          1.00000000
  1  1  1 11  3
       8676.50000000          0.00043570         -0.00017480          0.00004510
       2055.90000000          0.00378150         -0.00152630          0.00039640
        666.23000000          0.02047820         -0.00833990          0.00215550
        253.10000000          0.07928340         -0.03322030          0.00867200
        106.12000000          0.21784730         -0.09541800          0.02486800
         47.24200000          0.38785850         -0.18240260          0.04854720
         21.82500000          0.35943500         -0.15583080          0.03961560
          9.96840000          0.11219950          0.18678990         -0.06057490
          4.51710000          0.00438740          0.54277330         -0.18716990
          1.99820000          0.00178090          0.38733090         -0.13777570
          0.28145000          0.00021220         -0.00437840          0.57608960
  1  1  1  1  1
          0.70988000          1.00000000
  1  1  1  1  1
          0.10204000          1.00000000
  1  2  2  7  1
        403.83000000          0.00147320
        121.17000000          0.01267250
         46.34500000          0.05804510
         19.72100000          0.17051030
          8.86240000          0.31859580
          3.99620000          0.38450230
          1.76360000          0.27377370
  1  2  2  1  1
          0.70619000          1.00000000
  1  2  2  1  1
          0.26390000          1.00000000
  1  3  3  1  1
          0.55150000          1.00000000
  1  0  0  1  1
          0.04559300          1.00000000
  1  1  1  1  1
          0.03514200          1.00000000
  1  2  2  1  1
          0.10470000          1.00000000
  1  3  3  1  1
          0.25800000          1.00000000
# KRYPTON     (20s,13p,9d,1f) -> [6s,5p,3d,1f]
# KRYPTON     Diffuse (1s,1p,1d,1f)
KR aug-cc-pVTZ
 14
  1  0  0 18  4
   11718113.00000000          0.00000560         -0.00000180          0.00000000          0.00000000
    1754604.40000000          0.00004380         -0.00001380          0.00000550         -0.00000180
     399281.32000000          0.00023050         -0.00007260          0.00002920         -0.00000930
     113084.57000000          0.00097330         -0.00030630          0.00012280         -0.00003910
      36885.92500000          0.00353370         -0.00111770          0.00044910         -0.00014300
      13312.20900000          0.01141670         -0.00362700          0.00145570         -0.00046390
       5189.98830000          0.03313250         -0.01074320          0.00433190         -0.00138010
       2151.65970000          0.08544640         -0.02869920          0.01159650         -0.00370010
        938.03251000          0.18691240         -0.06866790          0.02815850         -0.00899210
        426.55732000          0.31497610         -0.13651550          0.05703390         -0.01830210
        201.06660000          0.33433340         -0.20224580          0.08913560         -0.02875590
         97.09760500          0.16088100         -0.10905690          0.05084210         -0.01673240
         42.99872400          0.01784350          0.33187680         -0.19210300          0.06524100
         21.17707500         -0.00137930          0.59482500         -0.51210400          0.18344220
         10.42675200          0.00065720          0.24248250         -0.18570070          0.06921830
          4.58500800         -0.00033880          0.01722410          0.66541190         -0.31560340
          2.11760300          0.00012110          0.00036850          0.60239250         -0.50315010
          0.34922500          0.00003660         -0.00011530         -0.01064530          0.71715710
  1  0  0  1  1
          0.70705700          1.00000000
  1  0  0  1  1
          0.14482100          1.00000000
  1  1  1 11  3
       9366.30900000          0.00042310         -0.00017200          0.00004660
       2219.55430000          0.00367430         -0.00150250          0.00041000
        719.45288000          0.01993120         -0.00822690          0.00223280
        273.46446000          0.07742220         -0.03285660          0.00901440
        114.75225000          0.21403860         -0.09501350          0.02601150
         51.15556900          0.38485560         -0.18331060          0.05133400
         23.68267600          0.36263400         -0.16121610          0.04309290
         10.87548400          0.11708180          0.17876440         -0.06150400
          4.95513100          0.00512100          0.54378850         -0.20034240
          2.21726700          0.00175390          0.39133870         -0.14573640
          0.32215400          0.00021990         -0.00478000          0.57645810
  1  1  1  1  1
          0.80641000          1.00000000
  1  1  1  1  1
          0.11761900          1.00000000
  1  2  2  7  1
        446.16133000          0.00140440
        133.96477000          0.01217150
         51.34590700          0.05639190
         21.91690600          0.16764300
          9.89372500          0.31773680
          4.49252700          0.38726470
          2.00229300          0.27280060
  1  2  2  1  1
          0.80840900          1.00000000
  1  2  2  1  1
          0.30060000          1.00000000
  1  3  3  1  1
          0.66220000          1.00000000
  1  0  0  1  1
          0.05198500          1.00000000
  1  1  1  1  1
          0.04003300          1.00000000
  1  2  2  1  1
          0.12570000          1.00000000
  1  3  3  1  1
          0.32800000          1.00000000
# BASIS="aug-cc-pVQZ"
#Elements                             References
#--------                             ----------
# H     : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He    : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
#Li - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#Na - Mg: D.E. Woon and T.H. Dunning, Jr.  (to be published)
#Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
#Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#Elements                             References
#--------                             ---------
# H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
# B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#         6769 (1992).
#Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN    (6s,3p,2d,1f) -> [4s,3p,2d,1f]
# HYDROGEN    Diffuse (1s,1p,1d,1f)
H  aug-cc-pVQZ
 14
  1  0  0  3  1
         82.64000000          0.00200600
         12.41000000          0.01534300
          2.82400000          0.07557900
  1  0  0  1  1
          0.79770000          1.00000000
  1  0  0  1  1
          0.25810000          1.00000000
  1  0  0  1  1
          0.08989000          1.00000000
  1  1  1  1  1
          2.29200000          1.00000000
  1  1  1  1  1
          0.83800000          1.00000000
  1  1  1  1  1
          0.29200000          1.00000000
  1  2  2  1  1
          2.06200000          1.00000000
  1  2  2  1  1
          0.66200000          1.00000000
  1  3  3  1  1
          1.39700000          1.00000000
  1  0  0  1  1
          0.02363000          1.00000000
  1  1  1  1  1
          0.08480000          1.00000000
  1  2  2  1  1
          0.19000000          1.00000000
  1  3  3  1  1
          0.36000000          1.00000000
# HELIUM      (7s,3p,2d,1f) -> [4s,3p,2d,1f]
# HELIUM      Diffuse (1s,1p,1d,1f)
HE aug-cc-pVQZ
 14
  1  0  0  4  1
        528.50000000          0.00094000
         79.31000000          0.00721400
         18.05000000          0.03597500
          5.08500000          0.12778200
  1  0  0  1  1
          1.60900000          1.00000000
  1  0  0  1  1
          0.53630000          1.00000000
  1  0  0  1  1
          0.18330000          1.00000000
  1  1  1  1  1
          5.99400000          1.00000000
  1  1  1  1  1
          1.74500000          1.00000000
  1  1  1  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          4.29900000          1.00000000
  1  2  2  1  1
          1.22300000          1.00000000
  1  3  3  1  1
          2.68000000          1.00000000
  1  0  0  1  1
          0.04819000          1.00000000
  1  1  1  1  1
          0.16260000          1.00000000
  1  2  2  1  1
          0.35100000          1.00000000
  1  3  3  1  1
          0.69060000          1.00000000
# BORON       (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# BORON       Diffuse (1s,1p,1d,1f,1g)
B  aug-cc-pVQZ
 19
  1  0  0  9  2
      23870.00000000          0.00008800         -0.00001800
       3575.00000000          0.00068700         -0.00013900
        812.80000000          0.00360000         -0.00072500
        229.70000000          0.01494900         -0.00306300
         74.69000000          0.05143500         -0.01058100
         26.81000000          0.14330200         -0.03136500
         10.32000000          0.30093500         -0.07101200
          4.17800000          0.40352600         -0.13210300
          1.72700000          0.22534000         -0.12307200
  1  0  0  1  1
          0.47040000          1.00000000
  1  0  0  1  1
          0.18960000          1.00000000
  1  0  0  1  1
          0.07394000          1.00000000
  1  1  1  3  1
         22.26000000          0.00509500
          5.05800000          0.03320600
          1.48700000          0.13231400
  1  1  1  1  1
          0.50710000          1.00000000
  1  1  1  1  1
          0.18120000          1.00000000
  1  1  1  1  1
          0.06463000          1.00000000
  1  2  2  1  1
          1.11000000          1.00000000
  1  2  2  1  1
          0.40200000          1.00000000
  1  2  2  1  1
          0.14500000          1.00000000
  1  3  3  1  1
          0.88200000          1.00000000
  1  3  3  1  1
          0.31100000          1.00000000
  1  4  4  1  1
          0.67300000          1.00000000
  1  0  0  1  1
          0.02721000          1.00000000
  1  1  1  1  1
          0.01878000          1.00000000
  1  2  2  1  1
          0.04660000          1.00000000
  1  3  3  1  1
          0.11300000          1.00000000
  1  4  4  1  1
          0.27300000          1.00000000
# CARBON      (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# CARBON      Diffuse (1s,1p,1d,1f,1g)
C  aug-cc-pVQZ
 19
  1  0  0  9  2
      33980.00000000          0.00009100         -0.00001900
       5089.00000000          0.00070400         -0.00015100
       1157.00000000          0.00369300         -0.00078500
        326.60000000          0.01536000         -0.00332400
        106.10000000          0.05292900         -0.01151200
         38.11000000          0.14704300         -0.03416000
         14.75000000          0.30563100         -0.07717300
          6.03500000          0.39934500         -0.14149300
          2.53000000          0.21705100         -0.11801900
  1  0  0  1  1
          0.73550000          1.00000000
  1  0  0  1  1
          0.29050000          1.00000000
  1  0  0  1  1
          0.11110000          1.00000000
  1  1  1  3  1
         34.51000000          0.00537800
          7.91500000          0.03613200
          2.36800000          0.14249300
  1  1  1  1  1
          0.81320000          1.00000000
  1  1  1  1  1
          0.28900000          1.00000000
  1  1  1  1  1
          0.10070000          1.00000000
  1  2  2  1  1
          1.84800000          1.00000000
  1  2  2  1  1
          0.64900000          1.00000000
  1  2  2  1  1
          0.22800000          1.00000000
  1  3  3  1  1
          1.41900000          1.00000000
  1  3  3  1  1
          0.48500000          1.00000000
  1  4  4  1  1
          1.01100000          1.00000000
  1  0  0  1  1
          0.04145000          1.00000000
  1  1  1  1  1
          0.03218000          1.00000000
  1  2  2  1  1
          0.07660000          1.00000000
  1  3  3  1  1
          0.18700000          1.00000000
  1  4  4  1  1
          0.42400000          1.00000000
# NITROGEN    (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# NITROGEN    Diffuse (1s,1p,1d,1f,1g)
N  aug-cc-pVQZ
 19
  1  0  0  9  2
      45840.00000000          0.00009200         -0.00002000
       6868.00000000          0.00071700         -0.00015900
       1563.00000000          0.00374900         -0.00082400
        442.40000000          0.01553200         -0.00347800
        144.30000000          0.05314600         -0.01196600
         52.18000000          0.14678700         -0.03538800
         20.34000000          0.30466300         -0.08007700
          8.38100000          0.39768400         -0.14672200
          3.52900000          0.21764100         -0.11636000
  1  0  0  1  1
          1.05400000          1.00000000
  1  0  0  1  1
          0.41180000          1.00000000
  1  0  0  1  1
          0.15520000          1.00000000
  1  1  1  3  1
         49.33000000          0.00553300
         11.37000000          0.03796200
          3.43500000          0.14902800
  1  1  1  1  1
          1.18200000          1.00000000
  1  1  1  1  1
          0.41730000          1.00000000
  1  1  1  1  1
          0.14280000          1.00000000
  1  2  2  1  1
          2.83700000          1.00000000
  1  2  2  1  1
          0.96800000          1.00000000
  1  2  2  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          2.02700000          1.00000000
  1  3  3  1  1
          0.68500000          1.00000000
  1  4  4  1  1
          1.42700000          1.00000000
  1  0  0  1  1
          0.05464000          1.00000000
  1  1  1  1  1
          0.04402000          1.00000000
  1  2  2  1  1
          0.11100000          1.00000000
  1  3  3  1  1
          0.24500000          1.00000000
  1  4  4  1  1
          0.55900000          1.00000000
# OXYGEN      (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# OXYGEN      Diffuse (1s,1p,1d,1f,1g)
O  aug-cc-pVQZ
 19
  1  0  0  9  2
      61420.00000000          0.00009000         -0.00002000
       9199.00000000          0.00069800         -0.00015900
       2091.00000000          0.00366400         -0.00082900
        590.90000000          0.01521800         -0.00350800
        192.30000000          0.05242300         -0.01215600
         69.32000000          0.14592100         -0.03626100
         26.97000000          0.30525800         -0.08299200
         11.10000000          0.39850800         -0.15209000
          4.68200000          0.21698000         -0.11533100
  1  0  0  1  1
          1.42800000          1.00000000
  1  0  0  1  1
          0.55470000          1.00000000
  1  0  0  1  1
          0.20670000          1.00000000
  1  1  1  3  1
         63.42000000          0.00604400
         14.66000000          0.04179900
          4.45900000          0.16114300
  1  1  1  1  1
          1.53100000          1.00000000
  1  1  1  1  1
          0.53020000          1.00000000
  1  1  1  1  1
          0.17500000          1.00000000
  1  2  2  1  1
          3.77500000          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.44400000          1.00000000
  1  3  3  1  1
          2.66600000          1.00000000
  1  3  3  1  1
          0.85900000          1.00000000
  1  4  4  1  1
          1.84600000          1.00000000
  1  0  0  1  1
          0.06959000          1.00000000
  1  1  1  1  1
          0.05348000          1.00000000
  1  2  2  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.32400000          1.00000000
  1  4  4  1  1
          0.71400000          1.00000000
# FLUORINE    (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# FLUORINE    Diffuse (1s,1p,1d,1f,1g)
F  aug-cc-pVQZ
 19
  1  0  0  9  2
      74530.00000000          0.00009500         -0.00002200
      11170.00000000          0.00073800         -0.00017200
       2543.00000000          0.00385800         -0.00089100
        721.00000000          0.01592600         -0.00374800
        235.90000000          0.05428900         -0.01286200
         85.60000000          0.14951300         -0.03806100
         33.55000000          0.30825200         -0.08623900
         13.93000000          0.39485300         -0.15586500
          5.91500000          0.21103100         -0.11091400
  1  0  0  1  1
          1.84300000          1.00000000
  1  0  0  1  1
          0.71240000          1.00000000
  1  0  0  1  1
          0.26370000          1.00000000
  1  1  1  3  1
         80.39000000          0.00634700
         18.63000000          0.04420400
          5.69400000          0.16851400
  1  1  1  1  1
          1.95300000          1.00000000
  1  1  1  1  1
          0.67020000          1.00000000
  1  1  1  1  1
          0.21660000          1.00000000
  1  2  2  1  1
          5.01400000          1.00000000
  1  2  2  1  1
          1.72500000          1.00000000
  1  2  2  1  1
          0.58600000          1.00000000
  1  3  3  1  1
          3.56200000          1.00000000
  1  3  3  1  1
          1.14800000          1.00000000
  1  4  4  1  1
          2.37600000          1.00000000
  1  0  0  1  1
          0.08594000          1.00000000
  1  1  1  1  1
          0.06568000          1.00000000
  1  2  2  1  1
          0.20700000          1.00000000
  1  3  3  1  1
          0.46000000          1.00000000
  1  4  4  1  1
          0.92400000          1.00000000
# NEON        (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]
# NEON        Diffuse (1s,1p,1d,1f,1g)
NE aug-cc-pVQZ
 19
  1  0  0  9  2
      99920.00000000          0.00008600         -0.00002000
      14960.00000000          0.00066900         -0.00015800
       3399.00000000          0.00351800         -0.00082400
        958.90000000          0.01466700         -0.00350000
        311.20000000          0.05096200         -0.01223300
        111.70000000          0.14374400         -0.03701700
         43.32000000          0.30456200         -0.08611300
         17.80000000          0.40010500         -0.15838100
          7.50300000          0.21864400         -0.11428800
  1  0  0  1  1
          2.33700000          1.00000000
  1  0  0  1  1
          0.90010000          1.00000000
  1  0  0  1  1
          0.33010000          1.00000000
  1  1  1  3  1
         99.68000000          0.00656600
         23.15000000          0.04597900
          7.10800000          0.17341900
  1  1  1  1  1
          2.44100000          1.00000000
  1  1  1  1  1
          0.83390000          1.00000000
  1  1  1  1  1
          0.26620000          1.00000000
  1  2  2  1  1
          6.47100000          1.00000000
  1  2  2  1  1
          2.21300000          1.00000000
  1  2  2  1  1
          0.74700000          1.00000000
  1  3  3  1  1
          4.65700000          1.00000000
  1  3  3  1  1
          1.52400000          1.00000000
  1  4  4  1  1
          2.98300000          1.00000000
  1  0  0  1  1
          0.10540000          1.00000000
  1  1  1  1  1
          0.08178000          1.00000000
  1  2  2  1  1
          0.27300000          1.00000000
  1  3  3  1  1
          0.68900000          1.00000000
  1  4  4  1  1
          1.22400000          1.00000000
# ALUMINUM    (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# ALUMINUM    Diffuse (1s,1p,1d,1f,1g)
AL aug-cc-pVQZ
 19
  1  0  0 13  3
     419600.00000000          0.00002782         -0.00000724          0.00000167
      62830.00000000          0.00021633         -0.00005617          0.00001296
      14290.00000000          0.00113754         -0.00029653          0.00006851
       4038.00000000          0.00479635         -0.00124913          0.00028827
       1312.00000000          0.01723890         -0.00455101          0.00105276
        470.50000000          0.05380660         -0.01443930          0.00333878
        181.80000000          0.14132600         -0.04034640          0.00939217
         74.46000000          0.28926800         -0.09226180          0.02160470
         31.90000000          0.38482500         -0.16451000          0.03958730
         13.96000000          0.23285200         -0.14129600          0.03491800
          5.18000000          0.02933300          0.19536500         -0.05284150
          2.26500000         -0.00300574          0.57247500         -0.19187800
          0.96640000          0.00166673          0.37404100         -0.25411500
  1  0  0  1  1
          0.24470000          1.00000000
  1  0  0  1  1
          0.11840000          1.00000000
  1  0  0  1  1
          0.05021000          1.00000000
  1  1  1  8  2
        891.30000000          0.00049175         -0.00008887
        211.30000000          0.00415843         -0.00074582
         68.28000000          0.02125380         -0.00387025
         25.70000000          0.07640580         -0.01393500
         10.63000000          0.19427700         -0.03668600
          4.60200000          0.33442800         -0.06277970
          2.01500000          0.37502600         -0.07896020
          0.87060000          0.20404100         -0.02885890
  1  1  1  1  1
          0.29720000          1.00000000
  1  1  1  1  1
          0.11000000          1.00000000
  1  1  1  1  1
          0.03989000          1.00000000
  1  2  2  1  1
          0.08040000          1.00000000
  1  2  2  1  1
          0.19900000          1.00000000
  1  2  2  1  1
          0.49400000          1.00000000
  1  3  3  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.40100000          1.00000000
  1  4  4  1  1
          0.35700000          1.00000000
  1  0  0  1  1
          0.01830000          1.00000000
  1  1  1  1  1
          0.01210000          1.00000000
  1  2  2  1  1
          0.02820000          1.00000000
  1  3  3  1  1
          0.05820000          1.00000000
  1  4  4  1  1
          0.15300000          1.00000000
# SILICON     (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# SILICON     Diffuse (1s,1p,1d,1f,1g)
SI aug-cc-pVQZ
 19
  1  0  0 13  3
     513000.00000000          0.00002609         -0.00000695          0.00000178
      76820.00000000          0.00020291         -0.00005396          0.00001381
      17470.00000000          0.00106715         -0.00028472          0.00007300
       4935.00000000          0.00450597         -0.00120203          0.00030767
       1602.00000000          0.01623590         -0.00438397          0.00112563
        574.10000000          0.05089130         -0.01397760          0.00358435
        221.50000000          0.13515500         -0.03935160          0.01017280
         90.54000000          0.28129200         -0.09142830          0.02375200
         38.74000000          0.38533600         -0.16560900          0.04434830
         16.95000000          0.24565100         -0.15250500          0.04190410
          6.45200000          0.03431450          0.16852400         -0.05025040
          2.87400000         -0.00334884          0.56928400         -0.21657800
          1.25000000          0.00187625          0.39805600         -0.28644800
  1  0  0  1  1
          0.35990000          1.00000000
  1  0  0  1  1
          0.16990000          1.00000000
  1  0  0  1  1
          0.07066000          1.00000000
  1  1  1  8  2
       1122.00000000          0.00044814         -0.00009649
        266.00000000          0.00381639         -0.00081197
         85.92000000          0.01981050         -0.00430087
         32.33000000          0.07270170         -0.01575020
         13.37000000          0.18983900         -0.04295410
          5.80000000          0.33567200         -0.07525740
          2.55900000          0.37936500         -0.09714460
          1.12400000          0.20119300         -0.02275070
  1  1  1  1  1
          0.39880000          1.00000000
  1  1  1  1  1
          0.15330000          1.00000000
  1  1  1  1  1
          0.05728000          1.00000000
  1  2  2  1  1
          0.12000000          1.00000000
  1  2  2  1  1
          0.30200000          1.00000000
  1  2  2  1  1
          0.76000000          1.00000000
  1  3  3  1  1
          0.21200000          1.00000000
  1  3  3  1  1
          0.54100000          1.00000000
  1  4  4  1  1
          0.46100000          1.00000000
  1  0  0  1  1
          0.02750000          1.00000000
  1  1  1  1  1
          0.02000000          1.00000000
  1  2  2  1  1
          0.04350000          1.00000000
  1  3  3  1  1
          0.08460000          1.00000000
  1  4  4  1  1
          0.21200000          1.00000000
# PHOSPHORUS  (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# PHOSPHORUS  Diffuse (1s,1p,1d,1f,1g)
P  aug-cc-pVQZ
 19
  1  0  0 13  3
     615200.00000000          0.00002475         -0.00000672          0.00000185
      92120.00000000          0.00019247         -0.00005223          0.00001434
      20950.00000000          0.00101202         -0.00027536          0.00007572
       5920.00000000          0.00427261         -0.00116307          0.00031921
       1922.00000000          0.01541610         -0.00424281          0.00116851
        688.00000000          0.04859760         -0.01361140          0.00374267
        265.00000000          0.13006000         -0.03851140          0.01068170
        108.20000000          0.27451400         -0.09066430          0.02526570
         46.22000000          0.38540200         -0.16658400          0.04792830
         20.23000000          0.25593400         -0.16144700          0.04770960
          7.85900000          0.03912370          0.14678100         -0.04665250
          3.54700000         -0.00368010          0.56668200         -0.23496800
          1.56400000          0.00208211          0.41643300         -0.31133700
  1  0  0  1  1
          0.48880000          1.00000000
  1  0  0  1  1
          0.22660000          1.00000000
  1  0  0  1  1
          0.09331000          1.00000000
  1  1  1  8  2
       1367.00000000          0.00042102         -0.00010083
        324.00000000          0.00360985         -0.00085450
        104.60000000          0.01892170         -0.00457116
         39.37000000          0.07055600         -0.01703270
         16.26000000          0.18815700         -0.04752040
          7.05600000          0.33870900         -0.08527860
          3.13000000          0.38194300         -0.10967600
          1.39400000          0.19526100         -0.01611810
  1  1  1  1  1
          0.51790000          1.00000000
  1  1  1  1  1
          0.20320000          1.00000000
  1  1  1  1  1
          0.07698000          1.00000000
  1  2  2  1  1
          0.16500000          1.00000000
  1  2  2  1  1
          0.41300000          1.00000000
  1  2  2  1  1
          1.03600000          1.00000000
  1  3  3  1  1
          0.28000000          1.00000000
  1  3  3  1  1
          0.70300000          1.00000000
  1  4  4  1  1
          0.59700000          1.00000000
  1  0  0  1  1
          0.03540000          1.00000000
  1  1  1  1  1
          0.02720000          1.00000000
  1  2  2  1  1
          0.05940000          1.00000000
  1  3  3  1  1
          0.10900000          1.00000000
  1  4  4  1  1
          0.25000000          1.00000000
# SULFUR      (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# SULFUR      Diffuse (1s,1p,1d,1f,1g)
S  aug-cc-pVQZ
 19
  1  0  0 13  3
     727800.00000000          0.00002360         -0.00000652          0.00000189
     109000.00000000          0.00018348         -0.00005066          0.00001469
      24800.00000000          0.00096428         -0.00026683          0.00007755
       7014.00000000          0.00406537         -0.00112601          0.00032651
       2278.00000000          0.01469730         -0.00411186          0.00119686
        814.70000000          0.04650810         -0.01324540          0.00384799
        313.40000000          0.12550800         -0.03770040          0.01105390
        127.70000000          0.26843300         -0.08985540          0.02646450
         54.48000000          0.38480900         -0.16709800          0.05087710
         23.85000000          0.26537200         -0.16935400          0.05300300
          9.42800000          0.04373260          0.12782400         -0.04255180
          4.29000000         -0.00378807          0.56486200         -0.25085300
          1.90900000          0.00218083          0.43176700         -0.33315200
  1  0  0  1  1
          0.62700000          1.00000000
  1  0  0  1  1
          0.28730000          1.00000000
  1  0  0  1  1
          0.11720000          1.00000000
  1  1  1  8  2
       1546.00000000          0.00044118         -0.00011311
        366.40000000          0.00377571         -0.00095858
        118.40000000          0.01983600         -0.00513471
         44.53000000          0.07420630         -0.01926410
         18.38000000          0.19732700         -0.05359800
          7.96500000          0.35185100         -0.09603330
          3.54100000          0.37868700         -0.11818300
          1.59100000          0.17093100          0.00923194
  1  1  1  1  1
          0.62050000          1.00000000
  1  1  1  1  1
          0.24200000          1.00000000
  1  1  1  1  1
          0.09014000          1.00000000
  1  2  2  1  1
          0.20300000          1.00000000
  1  2  2  1  1
          0.50400000          1.00000000
  1  2  2  1  1
          1.25000000          1.00000000
  1  3  3  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          0.86900000          1.00000000
  1  4  4  1  1
          0.68300000          1.00000000
  1  0  0  1  1
          0.04280000          1.00000000
  1  1  1  1  1
          0.03170000          1.00000000
  1  2  2  1  1
          0.07480000          1.00000000
  1  3  3  1  1
          0.14000000          1.00000000
  1  4  4  1  1
          0.29700000          1.00000000
# CHLORINE    (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# CHLORINE    Diffuse (1s,1p,1d,1f,1g)
CL aug-cc-pVQZ
 19
  1  0  0 13  3
     834900.00000000          0.00002317         -0.00000650          0.00000197
     125000.00000000          0.00018015         -0.00005049          0.00001526
      28430.00000000          0.00094778         -0.00026611          0.00008061
       8033.00000000          0.00400139         -0.00112499          0.00033996
       2608.00000000          0.01446290         -0.00410497          0.00124551
        933.90000000          0.04565860         -0.01319870          0.00399612
        360.00000000          0.12324800         -0.03753420          0.01147510
        147.00000000          0.26436900         -0.08972330          0.02755040
         62.88000000          0.38298900         -0.16767100          0.05329170
         27.60000000          0.27093400         -0.17476300          0.05712460
         11.08000000          0.04714040          0.11490900         -0.03952010
          5.07500000         -0.00371766          0.56361800         -0.26434300
          2.27800000          0.00219158          0.44160600         -0.34929100
  1  0  0  1  1
          0.77750000          1.00000000
  1  0  0  1  1
          0.35270000          1.00000000
  1  0  0  1  1
          0.14310000          1.00000000
  1  1  1  8  2
       1703.00000000          0.00047404         -0.00012827
        403.60000000          0.00406412         -0.00109356
        130.30000000          0.02133550         -0.00583429
         49.05000000          0.07946110         -0.02192580
         20.26000000          0.20892700         -0.06013850
          8.78700000          0.36494500         -0.10692900
          3.91900000          0.37172500         -0.12245400
          1.76500000          0.14629200          0.03836190
  1  1  1  1  1
          0.72070000          1.00000000
  1  1  1  1  1
          0.28390000          1.00000000
  1  1  1  1  1
          0.10600000          1.00000000
  1  2  2  1  1
          0.25400000          1.00000000
  1  2  2  1  1
          0.62800000          1.00000000
  1  2  2  1  1
          1.55100000          1.00000000
  1  3  3  1  1
          0.42300000          1.00000000
  1  3  3  1  1
          1.08900000          1.00000000
  1  4  4  1  1
          0.82700000          1.00000000
  1  0  0  1  1
          0.05190000          1.00000000
  1  1  1  1  1
          0.03760000          1.00000000
  1  2  2  1  1
          0.09520000          1.00000000
  1  3  3  1  1
          0.21700000          1.00000000
  1  4  4  1  1
          0.37800000          1.00000000
# ARGON       (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]
# ARGON       Diffuse (1s,1p,1d,1f,1g)
AR aug-cc-pVQZ
 19
  1  0  0 13  3
     950600.00000000          0.00002275         -0.00000646          0.00000202
     142300.00000000          0.00017695         -0.00005023          0.00001569
      32360.00000000          0.00093128         -0.00026480          0.00008286
       9145.00000000          0.00392860         -0.00111895          0.00034926
       2970.00000000          0.01420640         -0.00408276          0.00127976
       1064.00000000          0.04481140         -0.01312160          0.00410365
        410.80000000          0.12100100         -0.03728550          0.01177890
        168.00000000          0.26057900         -0.08947090          0.02838680
         71.99000000          0.38136400         -0.16805400          0.05524060
         31.67000000          0.27605800         -0.17959400          0.06074920
         12.89000000          0.05051790          0.10295300         -0.03620120
          5.92900000         -0.00359866          0.56263000         -0.27539800
          2.67800000          0.00218798          0.45035500         -0.36284500
  1  0  0  1  1
          0.94160000          1.00000000
  1  0  0  1  1
          0.42390000          1.00000000
  1  0  0  1  1
          0.17140000          1.00000000
  1  1  1  8  2
       1890.00000000          0.00049575         -0.00013886
        447.80000000          0.00425172         -0.00118870
        144.60000000          0.02232770         -0.00632553
         54.46000000          0.08308780         -0.02388130
         22.51000000          0.21711000         -0.06492380
          9.77400000          0.37450700         -0.11544400
          4.36800000          0.36644500         -0.12365100
          1.95900000          0.12924500          0.06490550
  1  1  1  1  1
          0.82600000          1.00000000
  1  1  1  1  1
          0.32970000          1.00000000
  1  1  1  1  1
          0.12420000          1.00000000
  1  2  2  1  1
          0.31100000          1.00000000
  1  2  2  1  1
          0.76300000          1.00000000
  1  2  2  1  1
          1.87300000          1.00000000
  1  3  3  1  1
          0.54300000          1.00000000
  1  3  3  1  1
          1.32500000          1.00000000
  1  4  4  1  1
          1.00700000          1.00000000
  1  0  0  1  1
          0.06100000          1.00000000
  1  1  1  1  1
          0.04350000          1.00000000
  1  2  2  1  1
          0.11600000          1.00000000
  1  3  3  1  1
          0.29400000          1.00000000
  1  4  4  1  1
          0.45900000          1.00000000
# GALLIUM     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# GALLIUM     Diffuse (1s,1p,1d,1f,1g)
GA aug-cc-pVQZ
 20
  1  0  0 18  4
   11274496.00000000          0.00000410         -0.00000130          0.00000000          0.00000000
    1688053.40000000          0.00003160         -0.00000980          0.00000370          0.00000000
     384140.83000000          0.00016620         -0.00005150          0.00001970         -0.00000460
     108807.03000000          0.00070170         -0.00021760          0.00008300         -0.00001930
      35497.69100000          0.00255080         -0.00079320          0.00030290         -0.00007050
      12815.10400000          0.00826530         -0.00258210          0.00098500         -0.00022900
       4998.10870000          0.02419500         -0.00766520          0.00293410         -0.00068350
       2072.88480000          0.06365720         -0.02075670          0.00795720         -0.00185050
        903.74582000          0.14576510         -0.05077580          0.01967610         -0.00459300
        410.44307000          0.27033130         -0.10738020          0.04217830         -0.00983430
        192.60636000          0.34915710         -0.18065200          0.07386450         -0.01738490
         92.04967800          0.23744330         -0.17367010          0.07475310         -0.01757520
         42.04781100          0.04808330          0.11082510         -0.05341080          0.01252540
         21.06921700         -0.00229660          0.54183660         -0.35739190          0.09034000
         10.44791500          0.00179040          0.44678990         -0.42507130          0.11047210
          4.77765800         -0.00082760          0.07621050          0.20109920         -0.06121190
          2.28256600          0.00035430         -0.00093710          0.71459660         -0.25617680
          1.03530300         -0.00014110          0.00178060          0.36881490         -0.26037720
  1  0  0  1  1
          0.25767400          1.00000000
  1  0  0  1  1
          0.11917900          1.00000000
  1  0  0  1  1
          0.05129400          1.00000000
  1  1  1 13  3
      22059.77100000          0.00005470         -0.00002070          0.00000340
       5222.31290000          0.00048650         -0.00018460          0.00003000
       1696.06010000          0.00279900         -0.00106400          0.00017500
        648.76573000          0.01223960         -0.00469460          0.00076420
        275.10267000          0.04274760         -0.01664860          0.00274580
        125.34634000          0.11871870         -0.04781140          0.00781400
         60.05433400          0.24858280         -0.10453030          0.01742150
         29.72376800          0.36016220         -0.16129650          0.02648520
         15.03978100          0.29501710         -0.11431700          0.01939500
          7.57227300          0.09847940          0.14590560         -0.03131290
          3.73867600          0.00876710          0.42719890         -0.08016340
          1.79678800          0.00139610          0.42404150         -0.10017290
          0.82991000          0.00007700          0.15994400         -0.01058780
  1  1  1  1  1
          0.27287400          1.00000000
  1  1  1  1  1
          0.10154000          1.00000000
  1  1  1  1  1
          0.03765800          1.00000000
  1  2  2  9  1
        766.43696000          0.00017450
        231.00425000          0.00165770
         89.78123800          0.00928990
         39.54668100          0.03489050
         18.60758300          0.09634530
          9.15128700          0.19557030
          4.56500500          0.28359420
          2.25306600          0.30825150
          1.08672300          0.25196200
  1  2  2  1  1
          0.50330400          1.00000000
  1  2  2  1  1
          0.21228300          1.00000000
  1  2  2  1  1
          0.08280000          1.00000000
  1  3  3  1  1
          0.18100000          1.00000000
  1  3  3  1  1
          0.47100000          1.00000000
  1  4  4  1  1
          0.40320000          1.00000000
  1  0  0  1  1
          0.01847500          1.00000000
  1  1  1  1  1
          0.01140600          1.00000000
  1  2  2  1  1
          0.02790000          1.00000000
  1  3  3  1  1
          0.06550000          1.00000000
  1  4  4  1  1
          0.16800000          1.00000000
# GERMANIUM   (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# GERMANIUM   Diffuse (1s,1p,1d,1f,1g)
GE aug-cc-pVQZ
 20
  1  0  0 18  4
   12360507.00000000          0.00000390         -0.00000120          0.00000000          0.00000000
    1850697.80000000          0.00003050         -0.00000950          0.00000370          0.00000000
     421131.42000000          0.00016050         -0.00004990          0.00001920         -0.00000490
     119278.26000000          0.00067760         -0.00021090          0.00008130         -0.00002080
      38912.27700000          0.00246370         -0.00076860          0.00029650         -0.00007610
      14048.68200000          0.00798350         -0.00250250          0.00096480         -0.00024720
       5480.69920000          0.02337740         -0.00742590          0.00287150         -0.00073730
       2274.20550000          0.06157420         -0.02012490          0.00779730         -0.00199810
        992.24129000          0.14150760         -0.04929860          0.01929220         -0.00496400
        450.99966000          0.26469420         -0.10486830          0.04162000         -0.01069300
        211.82024000          0.34832570         -0.17832750          0.07353680         -0.01908430
        101.41102000          0.24541960         -0.17895810          0.07783200         -0.02016430
         46.91409000          0.05356460          0.08738420         -0.04235820          0.01083620
         23.50895000         -0.00183800          0.52709200         -0.34475370          0.09621100
         11.68131100          0.00180490          0.46795510         -0.44567130          0.12799790
          5.43452600         -0.00084760          0.08922060          0.15115440         -0.05060650
          2.60880800          0.00036680         -0.00034230          0.71742950         -0.28529170
          1.19844200         -0.00015420          0.00191440          0.40356340         -0.30653590
  1  0  0  1  1
          0.32980800          1.00000000
  1  0  0  1  1
          0.15543300          1.00000000
  1  0  0  1  1
          0.06691300          1.00000000
  1  1  1 13  3
      24017.46600000          0.00005310         -0.00002040          0.00000400
       5685.71750000          0.00047200         -0.00018180          0.00003570
       1846.48590000          0.00271870         -0.00104910          0.00020800
        706.24981000          0.01191450         -0.00463920          0.00091210
        299.45610000          0.04176250         -0.01650900          0.00328230
        136.43904000          0.11658940         -0.04766090          0.00941390
         65.39015500          0.24583380         -0.10496780          0.02109170
         32.39373500          0.35912610         -0.16337450          0.03250000
         16.41561600          0.29779290         -0.11809980          0.02399720
          8.28778700          0.10177080          0.14201780         -0.03711860
          4.11263400          0.00940720          0.42743240         -0.09881300
          1.99885400          0.00143500          0.42561670         -0.12356590
          0.94429100          0.00003540          0.15820340         -0.01101330
  1  1  1  1  1
          0.34121100          1.00000000
  1  1  1  1  1
          0.13435000          1.00000000
  1  1  1  1  1
          0.05173500          1.00000000
  1  2  2  9  1
        864.67411000          0.00016450
        261.03763000          0.00156540
        101.77030000          0.00879540
         45.11664100          0.03318520
         21.43068600          0.09195370
         10.65986100          0.18920170
          5.39228700          0.28058920
          2.70449700          0.31174740
          1.32854400          0.25541970
  1  2  2  1  1
          0.62645200          1.00000000
  1  2  2  1  1
          0.26601300          1.00000000
  1  2  2  1  1
          0.10630000          1.00000000
  1  3  3  1  1
          0.54920000          1.00000000
  1  3  3  1  1
          0.21900000          1.00000000
  1  4  4  1  1
          0.46810000          1.00000000
  1  0  0  1  1
          0.02639000          1.00000000
  1  1  1  1  1
          0.01855000          1.00000000
  1  2  2  1  1
          0.03970000          1.00000000
  1  3  3  1  1
          0.08840000          1.00000000
  1  4  4  1  1
          0.21430000          1.00000000
# ARSENIC     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# ARSENIC     Diffuse (1s,1p,1d,1f,1g)
AS aug-cc-pVQZ
 20
  1  0  0 18  4
   13600341.00000000          0.00000380         -0.00000120          0.00000000          0.00000000
    2036507.30000000          0.00002920         -0.00000910          0.00000360         -0.00000100
     463432.78000000          0.00015380         -0.00004800          0.00001870         -0.00000520
     131259.94000000          0.00064960         -0.00020280          0.00007900         -0.00002170
      42819.19200000          0.00236250         -0.00073920          0.00028810         -0.00007940
      15457.01900000          0.00766090         -0.00240890          0.00093860         -0.00025830
       6028.45830000          0.02246720         -0.00715380          0.00279460         -0.00077090
       2500.55990000          0.05934250         -0.01943330          0.00760980         -0.00209460
       1090.61490000          0.13710150         -0.04774710          0.01886990         -0.00521640
        495.62154000          0.25894720         -0.10226390          0.04100630         -0.01131630
        232.81669000          0.34728470         -0.17583260          0.07312750         -0.02039350
        111.63118000          0.25342470         -0.18374940          0.08071940         -0.02246640
         52.26995000          0.05962660          0.06482760         -0.03163000          0.00855900
         26.14987800         -0.00118610          0.51092810         -0.33173760          0.09956920
         13.01875700          0.00177910          0.48731430         -0.46382210          0.14345010
          6.15543200         -0.00084550          0.10336360          0.10369900         -0.03719010
          2.95912700          0.00036600          0.00063550          0.71829860         -0.30853680
          1.37387400         -0.00016220          0.00197660          0.43533050         -0.34786490
  1  0  0  1  1
          0.40885000          1.00000000
  1  0  0  1  1
          0.19451100          1.00000000
  1  0  0  1  1
          0.08364100          1.00000000
  1  1  1 13  3
      25570.41800000          0.00005330         -0.00002080          0.00000460
       6052.92370000          0.00047440         -0.00018550          0.00004120
       1965.70020000          0.00273300         -0.00107040          0.00023930
        751.77229000          0.01198710         -0.00473920          0.00105310
        318.68140000          0.04207660         -0.01688850          0.00378630
        145.14749000          0.11758910         -0.04884450          0.01091010
         69.54116200          0.24787470         -0.10759890          0.02438530
         34.45137600          0.36051480         -0.16693760          0.03764820
         17.46061000          0.29559210         -0.11692140          0.02651370
          8.80860900          0.09921630          0.15145050         -0.04454640
          4.37864600          0.00878660          0.43717310         -0.11676810
          2.14440500          0.00144620          0.41970780         -0.14094410
          1.02935000         -0.00004470          0.14376360         -0.00121210
  1  1  1  1  1
          0.40463600          1.00000000
  1  1  1  1  1
          0.16562200          1.00000000
  1  1  1  1  1
          0.06561000          1.00000000
  1  2  2  9  1
        996.97960000          0.00014620
        300.98518000          0.00140340
        117.23473000          0.00801950
         51.95690400          0.03100480
         24.68944000          0.08784780
         12.29517100          0.18522500
          6.24465200          0.28082510
          3.15546000          0.31631980
          1.56804900          0.25711920
  1  2  2  1  1
          0.74864700          1.00000000
  1  2  2  1  1
          0.31912500          1.00000000
  1  2  2  1  1
          0.13000000          1.00000000
  1  3  3  1  1
          0.26400000          1.00000000
  1  3  3  1  1
          0.64400000          1.00000000
  1  4  4  1  1
          0.54650000          1.00000000
  1  0  0  1  1
          0.03249900          1.00000000
  1  1  1  1  1
          0.02369800          1.00000000
  1  2  2  1  1
          0.05310000          1.00000000
  1  3  3  1  1
          0.11320000          1.00000000
  1  4  4  1  1
          0.23900000          1.00000000
# SELENIUM    (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# SELENIUM    Diffuse (1s,1p,1d,1f,1g)
SE aug-cc-pVQZ
 20
  1  0  0 18  4
   15011000.00000000          0.00000360         -0.00000110          0.00000000          0.00000000
    2247500.00000000          0.00002790         -0.00000870          0.00000340         -0.00000100
     511450.00000000          0.00014660         -0.00004590          0.00001810         -0.00000530
     144870.00000000          0.00061900         -0.00019390          0.00007630         -0.00002230
      47261.00000000          0.00225140         -0.00070640          0.00027810         -0.00008140
      17062.00000000          0.00730300         -0.00230300          0.00090680         -0.00026490
       6654.50000000          0.02144420         -0.00684250          0.00269990         -0.00079060
       2759.80000000          0.05681220         -0.01863350          0.00737260         -0.00215390
       1203.20000000          0.13208070         -0.04595120          0.01833600         -0.00538120
        546.53000000          0.25234690         -0.09921930          0.04018120         -0.01176940
        256.63000000          0.34592960         -0.17288130          0.07248640         -0.02146290
        123.14000000          0.26238900         -0.18849730          0.08356260         -0.02469040
         58.26300000          0.06679380          0.04226100         -0.02075920          0.00577740
         29.02300000         -0.00033320          0.49367910         -0.31835350          0.10152090
         14.46500000          0.00172750          0.50528180         -0.47983330          0.15785700
          6.93480000         -0.00082990          0.11841500          0.05928190         -0.02242190
          3.32990000          0.00035780          0.00195670          0.71741160         -0.32907760
          1.56000000         -0.00016660          0.00196480          0.46386360         -0.38734430
  1  0  0  1  1
          0.49291000          1.00000000
  1  0  0  1  1
          0.23525000          1.00000000
  1  0  0  1  1
          0.10037000          1.00000000
  1  1  1 13  3
      25217.00000000          0.00006100         -0.00002410          0.00000580
       5969.90000000          0.00054240         -0.00021520          0.00005200
       1938.90000000          0.00311740         -0.00123860          0.00029980
        741.66000000          0.01359770         -0.00546070          0.00132010
        314.50000000          0.04727880         -0.01929360          0.00468570
        143.31000000          0.12978560         -0.05497150          0.01337370
         68.65000000          0.26573830         -0.11779520          0.02892450
         33.99500000          0.36735440         -0.17407820          0.04294540
         17.18500000          0.27478050         -0.09557980          0.02232720
          8.57400000          0.07916790          0.20597140         -0.06360310
          4.22060000          0.00513490          0.47354310         -0.14361470
          2.05210000          0.00133190          0.38319220         -0.14472930
          0.96156000         -0.00020330          0.09208720          0.06303800
  1  1  1  1  1
          0.42151000          1.00000000
  1  1  1  1  1
          0.17626000          1.00000000
  1  1  1  1  1
          0.07066300          1.00000000
  1  2  2  9  1
       1143.40000000          0.00013010
        345.33000000          0.00125730
        134.46000000          0.00728820
         59.56700000          0.02886470
         28.28300000          0.08389870
         14.06100000          0.18197710
          7.13900000          0.28260570
          3.61480000          0.32204530
          1.80720000          0.25816330
  1  2  2  1  1
          0.86944000          1.00000000
  1  2  2  1  1
          0.37036000          1.00000000
  1  2  2  1  1
          0.15300000          1.00000000
  1  3  3  1  1
          0.28400000          1.00000000
  1  3  3  1  1
          0.70970000          1.00000000
  1  4  4  1  1
          0.57300000          1.00000000
  1  0  0  1  1
          0.03815200          1.00000000
  1  1  1  1  1
          0.02656900          1.00000000
  1  2  2  1  1
          0.06190000          1.00000000
  1  3  3  1  1
          0.12400000          1.00000000
  1  4  4  1  1
          0.26300000          1.00000000
# BROMINE     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# BROMINE     Diffuse (1s,1p,1d,1f,1g)
BR aug-cc-pVQZ
 20
  1  0  0 18  4
   16475000.00000000          0.00000340         -0.00000110          0.00000000          0.00000000
    2466600.00000000          0.00002670         -0.00000840          0.00000330         -0.00000100
     561310.00000000          0.00014040         -0.00004410          0.00001750         -0.00000540
     158990.00000000          0.00059270         -0.00018620          0.00007400         -0.00002270
      51869.00000000          0.00215610         -0.00067830          0.00026970         -0.00008270
      18726.00000000          0.00699590         -0.00221220          0.00087990         -0.00026940
       7303.60000000          0.02056450         -0.00657520          0.00261980         -0.00080420
       3029.10000000          0.05458930         -0.01793280          0.00716710         -0.00219490
       1320.80000000          0.12752260         -0.04433210          0.01785610         -0.00549390
        600.03000000          0.24597800         -0.09634780          0.03939600         -0.01209600
        281.90000000          0.34365080         -0.16968140          0.07171020         -0.02226230
        135.54000000          0.27025300         -0.19207690          0.08588770         -0.02660630
         64.87000000          0.07447950          0.02087310         -0.01038610          0.00275800
         32.12900000          0.00087870          0.47449960         -0.30401350          0.10168030
         16.03700000          0.00157550          0.52149070         -0.49331780          0.17041320
          7.78490000         -0.00076020          0.13480010          0.01608900         -0.00622200
          3.72470000          0.00032110          0.00366140          0.71466860         -0.34525700
          1.75830000         -0.00015860          0.00188400          0.49047950         -0.42348400
  1  0  0  1  1
          0.58331000          1.00000000
  1  0  0  1  1
          0.27856000          1.00000000
  1  0  0  1  1
          0.11829000          1.00000000
  1  1  1 13  3
      26607.00000000          0.00006190         -0.00002480          0.00000640
       6298.20000000          0.00054990         -0.00022120          0.00005720
       2045.20000000          0.00316200         -0.00127360          0.00032970
        782.16000000          0.01379790         -0.00561790          0.00145620
        331.63000000          0.04798120         -0.01986000          0.00515910
        151.11000000          0.13157100         -0.05655310          0.01476170
         72.39200000          0.26858610         -0.12094790          0.03176940
         35.86200000          0.36834730         -0.17730980          0.04706800
         18.13400000          0.27113630         -0.09214720          0.02238710
          9.04300000          0.07622220          0.21876830         -0.07202540
          4.45000000          0.00467490          0.48546700         -0.16264290
          2.16610000          0.00125650          0.37219700         -0.14965030
          0.99628000         -0.00023570          0.07769070          0.10645170
  1  1  1  1  1
          0.45443000          1.00000000
  1  1  1  1  1
          0.19404000          1.00000000
  1  1  1  1  1
          0.07899700          1.00000000
  1  2  2  9  1
       1289.60000000          0.00011900
        389.75000000          0.00115510
        151.76000000          0.00676480
         67.22300000          0.02730170
         31.91300000          0.08092980
         15.85700000          0.17940110
          8.05450000          0.28400860
          4.08870000          0.32667970
          2.05560000          0.25849000
  1  2  2  1  1
          0.99509000          1.00000000
  1  2  2  1  1
          0.42313000          1.00000000
  1  2  2  1  1
          0.17790000          1.00000000
  1  3  3  1  1
          0.34070000          1.00000000
  1  3  3  1  1
          0.82570000          1.00000000
  1  4  4  1  1
          0.64910000          1.00000000
  1  0  0  1  1
          0.04427000          1.00000000
  1  1  1  1  1
          0.03051300          1.00000000
  1  2  2  1  1
          0.08290000          1.00000000
  1  3  3  1  1
          0.17480000          1.00000000
  1  4  4  1  1
          0.31100000          1.00000000
# KRYPTON     (21s,16p,12d,2f,1g) -> [7s,6p,4d,2f,1g]
# KRYPTON     Diffuse (1s,1p,1d,1f,1g)
KR aug-cc-pVQZ
 20
  1  0  0 18  4
   18226108.00000000          0.00000320         -0.00000100          0.00000000          0.00000000
    2728802.50000000          0.00002520         -0.00000790          0.00000320         -0.00000100
     620997.71000000          0.00013280         -0.00004180          0.00001680         -0.00000530
     175899.58000000          0.00056070         -0.00017660          0.00007090         -0.00002260
      57387.49700000          0.00204010         -0.00064340          0.00025820         -0.00008230
      20717.18100000          0.00662350         -0.00209990          0.00084330         -0.00026840
       8078.88990000          0.01949960         -0.00624530          0.00251150         -0.00080140
       3349.51700000          0.05193640         -0.01708040          0.00689210         -0.00219370
       1459.78120000          0.12211660         -0.04238150          0.01722200         -0.00550740
        662.89391000          0.23836530         -0.09286790          0.03831590         -0.01222660
        311.39215000          0.34070510         -0.16573900          0.07054380         -0.02276170
        149.93751000          0.27928550         -0.19550880          0.08807170         -0.02836060
         72.49824900          0.08409920         -0.00164090          0.00063280         -0.00075650
         35.56935400          0.00250420          0.45300710         -0.28810650          0.10013650
         17.76663300          0.00135740          0.53707510         -0.50497970          0.18153320
          8.71238300         -0.00065910          0.15289710         -0.02677730          0.01118670
          4.14497100          0.00027010          0.00574110          0.70987180         -0.35758430
          1.96964900         -0.00014360          0.00174140          0.51580200         -0.45723050
  1  0  0  1  1
          0.67995200          1.00000000
  1  0  0  1  1
          0.32450200          1.00000000
  1  0  0  1  1
          0.13744100          1.00000000
  1  1  1 13  3
      28600.83100000          0.00006050         -0.00002460          0.00000670
       6770.99120000          0.00053780         -0.00021920          0.00005960
       2199.04890000          0.00309340         -0.00126280          0.00034320
        841.17957000          0.01351500         -0.00557560          0.00151900
        356.76633000          0.04709590         -0.01975460          0.00538810
        162.63620000          0.12962000         -0.05644880          0.01549350
         77.96603500          0.26611080         -0.12149230          0.03351760
         38.66148900          0.36780580         -0.17949070          0.05019110
         19.57679100          0.27403720         -0.09623140          0.02445500
          9.79176100          0.07871130          0.21631900         -0.07529530
          4.83538300          0.00498420          0.48997210         -0.17605340
          2.36812500          0.00122670          0.37267580         -0.15707240
          1.08999600         -0.00024480          0.07500880          0.13045790
  1  1  1  1  1
          0.50458800          1.00000000
  1  1  1  1  1
          0.21845500          1.00000000
  1  1  1  1  1
          0.08995900          1.00000000
  1  2  2  9  1
       1437.77920000          0.00011080
        434.26846000          0.00108280
        168.92699000          0.00640650
         74.77753500          0.02623790
         35.51602400          0.07882350
         17.67105100          0.17706770
          9.00461100          0.28396220
          4.59477300          0.32947020
          2.32648600          0.25890010
  1  2  2  1  1
          1.13324700          1.00000000
  1  2  2  1  1
          0.48130700          1.00000000
  1  2  2  1  1
          0.20530000          1.00000000
  1  3  3  1  1
          0.41300000          1.00000000
  1  3  3  1  1
          0.95570000          1.00000000
  1  4  4  1  1
          0.73950000          1.00000000
  1  0  0  1  1
          0.05038800          1.00000000
  1  1  1  1  1
          0.03445700          1.00000000
  1  2  2  1  1
          0.10390000          1.00000000
  1  3  3  1  1
          0.22560000          1.00000000
  1  4  4  1  1
          0.35900000          1.00000000
#  aug-cc-pV5Z  EMSL  Basis Set Exchange Library  6/6/08 12:02 AM
# Elements                             References
# --------                             ----------
# H      : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# He     : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
# Li     : Unofficial set from D. Feller.
# B  - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
# Na - Mg: Unofficial set from D. Feller.
# Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
# Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
#
# Elements                             References
# --------                             ---------
#  H    :  T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
#          Diffuse s exponent - S. Mielke
#  He   :  D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
#  B - F:  R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
#          6796 (1992).
# Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
#
# HYDROGEN
H  aug-cc-pV5Z
 16
  1  0  0  8  5
        402.00000000          0.00027900          0.00000000          0.00000000          0.00000000          0.00000000
         60.24000000          0.00216500          0.00000000          0.00000000          0.00000000          0.00000000
         13.73000000          0.01120100          0.00000000          0.00000000          0.00000000          0.00000000
          3.90500000          0.04487800          0.00000000          0.00000000          0.00000000          0.00000000
          1.28300000          0.14229900          1.00000000          0.00000000          0.00000000          0.00000000
          0.46550000          0.33097900          0.00000000          1.00000000          0.00000000          0.00000000
          0.18110000          0.43626900          0.00000000          0.00000000          1.00000000          0.00000000
          0.07279000          0.17644000          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  1  1
          4.51600000          1.00000000
  1  1  1  1  1
          1.71200000          1.00000000
  1  1  1  1  1
          0.64900000          1.00000000
  1  1  1  1  1
          0.24600000          1.00000000
  1  2  2  1  1
          2.95000000          1.00000000
  1  2  2  1  1
          1.20600000          1.00000000
  1  2  2  1  1
          0.49300000          1.00000000
  1  3  3  1  1
          2.50600000          1.00000000
  1  3  3  1  1
          0.87500000          1.00000000
  1  4  4  1  1
          2.35800000          1.00000000
  1  0  0  1  1
          0.02070000          1.00000000
  1  1  1  1  1
          0.07440000          1.00000000
  1  2  2  1  1
          0.15600000          1.00000000
  1  3  3  1  1
          0.27400000          1.00000000
  1  4  4  1  1
          0.54300000          1.00000000
# HELIUM
He aug-cc-pV5Z
 16
  1  0  0  8  5
       1145.00000000          0.00035900          0.00000000          0.00000000          0.00000000          0.00000000
        171.70000000          0.00277100          0.00000000          0.00000000          0.00000000          0.00000000
         39.07000000          0.01425100          0.00000000          0.00000000          0.00000000          0.00000000
         11.04000000          0.05556600          0.00000000          0.00000000          0.00000000          0.00000000
          3.56600000          0.16209100          1.00000000          0.00000000          0.00000000          0.00000000
          1.24000000          0.33219700          0.00000000          1.00000000          0.00000000          0.00000000
          0.44730000          0.41961500          0.00000000          0.00000000          1.00000000          0.00000000
          0.16400000          0.18612800          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  1  1
         10.15300000          1.00000000
  1  1  1  1  1
          3.62700000          1.00000000
  1  1  1  1  1
          1.29600000          1.00000000
  1  1  1  1  1
          0.46300000          1.00000000
  1  2  2  1  1
          7.66600000          1.00000000
  1  2  2  1  1
          2.64700000          1.00000000
  1  2  2  1  1
          0.91400000          1.00000000
  1  3  3  1  1
          5.41100000          1.00000000
  1  3  3  1  1
          1.70700000          1.00000000
  1  4  4  1  1
          3.43000000          1.00000000
  1  0  0  1  1
          0.04664000          1.00000000
  1  1  1  1  1
          0.14000000          1.00000000
  1  2  2  1  1
          0.28920000          1.00000000
  1  3  3  1  1
          0.53450000          1.00000000
  1  4  4  1  1
          0.78990000          1.00000000
# BORON
B  aug-cc-pV5Z
 18
  1  0  0 14  6
      68260.00000000          0.00002400         -0.00000500          0.00000000          0.00000000          0.00000000          0.00000000
      10230.00000000          0.00018500         -0.00003700          0.00000000          0.00000000          0.00000000          0.00000000
       2328.00000000          0.00097000         -0.00019600          0.00000000          0.00000000          0.00000000          0.00000000
        660.40000000          0.00405600         -0.00082400          0.00000000          0.00000000          0.00000000          0.00000000
        216.20000000          0.01439900         -0.00292300          0.00000000          0.00000000          0.00000000          0.00000000
         78.60000000          0.04390100         -0.00913800          0.00000000          0.00000000          0.00000000          0.00000000
         30.98000000          0.11305700         -0.02410500          0.00000000          0.00000000          0.00000000          0.00000000
         12.96000000          0.23382500         -0.05475500          0.00000000          0.00000000          0.00000000          0.00000000
          5.65900000          0.35396000         -0.09694300          0.00000000          0.00000000          0.00000000          0.00000000
          2.55600000          0.30154700         -0.13748500          0.00000000          0.00000000          0.00000000          0.00000000
          1.17500000          0.08752100         -0.04456500          1.00000000          0.00000000          0.00000000          0.00000000
          0.42490000          0.00281900          0.32434500          0.00000000          1.00000000          0.00000000          0.00000000
          0.17120000          0.00004300          0.57041400          0.00000000          0.00000000          1.00000000          0.00000000
          0.06913000          0.00007800          0.24344400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
         66.44000000          0.00083800          0.00000000          0.00000000          0.00000000          0.00000000
         15.71000000          0.00640900          0.00000000          0.00000000          0.00000000          0.00000000
          4.93600000          0.02808100          0.00000000          0.00000000          0.00000000          0.00000000
          1.77000000          0.09215200          0.00000000          0.00000000          0.00000000          0.00000000
          0.70080000          0.22416400          1.00000000          0.00000000          0.00000000          0.00000000
          0.29010000          0.36991500          0.00000000          1.00000000          0.00000000          0.00000000
          0.12110000          0.37444100          0.00000000          0.00000000          1.00000000          0.00000000
          0.04973000          0.13908600          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          2.01000000          1.00000000
  1  2  2  1  1
          0.79600000          1.00000000
  1  2  2  1  1
          0.31600000          1.00000000
  1  2  2  1  1
          0.12500000          1.00000000
  1  3  3  1  1
          1.21500000          1.00000000
  1  3  3  1  1
          0.52500000          1.00000000
  1  3  3  1  1
          0.22700000          1.00000000
  1  4  4  1  1
          1.12400000          1.00000000
  1  4  4  1  1
          0.46100000          1.00000000
  1  5  5  1  1
          0.83400000          1.00000000
  1  0  0  1  1
          0.02610000          1.00000000
  1  1  1  1  1
          0.01570000          1.00000000
  1  2  2  1  1
          0.04310000          1.00000000
  1  3  3  1  1
          0.08430000          1.00000000
  1  4  4  1  1
          0.20200000          1.00000000
  1  5  5  1  1
          0.38400000          1.00000000
# CARBON
C  aug-cc-pV5Z
 18
  1  0  0 14  6
      96770.00000000          0.00002500         -0.00000500          0.00000000          0.00000000          0.00000000          0.00000000
      14500.00000000          0.00019000         -0.00004100          0.00000000          0.00000000          0.00000000          0.00000000
       3300.00000000          0.00100000         -0.00021300          0.00000000          0.00000000          0.00000000          0.00000000
        935.80000000          0.00418300         -0.00089700          0.00000000          0.00000000          0.00000000          0.00000000
        306.20000000          0.01485900         -0.00318700          0.00000000          0.00000000          0.00000000          0.00000000
        111.30000000          0.04530100         -0.00996100          0.00000000          0.00000000          0.00000000          0.00000000
         43.90000000          0.11650400         -0.02637500          0.00000000          0.00000000          0.00000000          0.00000000
         18.40000000          0.24024900         -0.06000100          0.00000000          0.00000000          0.00000000          0.00000000
          8.05400000          0.35879900         -0.10682500          0.00000000          0.00000000          0.00000000          0.00000000
          3.63700000          0.29394100         -0.14416600          0.00000000          0.00000000          0.00000000          0.00000000
          1.65600000          0.07766500         -0.02464420          1.00000000          0.00000000          0.00000000          0.00000000
          0.63330000          0.00233300          0.34900900          0.00000000          1.00000000          0.00000000          0.00000000
          0.25450000          0.00050500          0.55873700          0.00000000          0.00000000          1.00000000          0.00000000
          0.10190000          0.00003000          0.22810200          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        101.80000000          0.00089100          0.00000000          0.00000000          0.00000000          0.00000000
         24.04000000          0.00697600          0.00000000          0.00000000          0.00000000          0.00000000
          7.57100000          0.03166900          0.00000000          0.00000000          0.00000000          0.00000000
          2.73200000          0.10400600          0.00000000          0.00000000          0.00000000          0.00000000
          1.08500000          0.24163300          1.00000000          0.00000000          0.00000000          0.00000000
          0.44960000          0.37194600          0.00000000          1.00000000          0.00000000          0.00000000
          0.18760000          0.35420000          0.00000000          0.00000000          1.00000000          0.00000000
          0.07606000          0.13156800          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          3.13400000          1.00000000
  1  2  2  1  1
          1.23300000          1.00000000
  1  2  2  1  1
          0.48500000          1.00000000
  1  2  2  1  1
          0.19100000          1.00000000
  1  3  3  1  1
          2.00600000          1.00000000
  1  3  3  1  1
          0.83800000          1.00000000
  1  3  3  1  1
          0.35000000          1.00000000
  1  4  4  1  1
          1.75300000          1.00000000
  1  4  4  1  1
          0.67800000          1.00000000
  1  5  5  1  1
          1.25900000          1.00000000
  1  0  0  1  1
          0.03940000          1.00000000
  1  1  1  1  1
          0.02720000          1.00000000
  1  2  2  1  1
          0.07010000          1.00000000
  1  3  3  1  1
          0.13800000          1.00000000
  1  4  4  1  1
          0.31900000          1.00000000
  1  5  5  1  1
          0.58600000          1.00000000
# NITROGEN
N  aug-cc-pV5Z
 18
  1  0  0 14  6
     129200.00000000          0.00002500         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      19350.00000000          0.00019700         -0.00004300          0.00000000          0.00000000          0.00000000          0.00000000
       4404.00000000          0.00103200         -0.00022700          0.00000000          0.00000000          0.00000000          0.00000000
       1248.00000000          0.00432500         -0.00095800          0.00000000          0.00000000          0.00000000          0.00000000
        408.00000000          0.01538000         -0.00341600          0.00000000          0.00000000          0.00000000          0.00000000
        148.20000000          0.04686700         -0.01066700          0.00000000          0.00000000          0.00000000          0.00000000
         58.50000000          0.12011600         -0.02827900          0.00000000          0.00000000          0.00000000          0.00000000
         24.59000000          0.24569500         -0.06402000          0.00000000          0.00000000          0.00000000          0.00000000
         10.81000000          0.36137900         -0.11393200          0.00000000          0.00000000          0.00000000          0.00000000
          4.88200000          0.28728300         -0.14699500          0.00000000          0.00000000          0.00000000          0.00000000
          2.19500000          0.07017100         -0.00725100          1.00000000          0.00000000          0.00000000          0.00000000
          0.87150000          0.00183100          0.36618300          0.00000000          1.00000000          0.00000000          0.00000000
          0.35040000          0.00083500          0.54790800          0.00000000          0.00000000          1.00000000          0.00000000
          0.13970000         -0.00000600          0.21664500          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        147.00000000          0.00089200          0.00000000          0.00000000          0.00000000          0.00000000
         34.76000000          0.00708200          0.00000000          0.00000000          0.00000000          0.00000000
         11.00000000          0.03281600          0.00000000          0.00000000          0.00000000          0.00000000
          3.99500000          0.10820900          0.00000000          0.00000000          0.00000000          0.00000000
          1.58700000          0.24809400          1.00000000          0.00000000          0.00000000          0.00000000
          0.65330000          0.37451300          0.00000000          1.00000000          0.00000000          0.00000000
          0.26860000          0.34841400          0.00000000          0.00000000          1.00000000          0.00000000
          0.10670000          0.12834000          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          4.64700000          1.00000000
  1  2  2  1  1
          1.81300000          1.00000000
  1  2  2  1  1
          0.70700000          1.00000000
  1  2  2  1  1
          0.27600000          1.00000000
  1  3  3  1  1
          2.94200000          1.00000000
  1  3  3  1  1
          1.20400000          1.00000000
  1  3  3  1  1
          0.49300000          1.00000000
  1  4  4  1  1
          2.51100000          1.00000000
  1  4  4  1  1
          0.94200000          1.00000000
  1  5  5  1  1
          1.76800000          1.00000000
  1  0  0  1  1
          0.05180000          1.00000000
  1  1  1  1  1
          0.03690000          1.00000000
  1  2  2  1  1
          0.09710000          1.00000000
  1  3  3  1  1
          0.19200000          1.00000000
  1  4  4  1  1
          0.43600000          1.00000000
  1  5  5  1  1
          0.78800000          1.00000000
# OXYGEN
O  aug-cc-pV5Z
 18
  1  0  0 14  6
     164200.00000000          0.00002600         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      24590.00000000          0.00020500         -0.00004600          0.00000000          0.00000000          0.00000000          0.00000000
       5592.00000000          0.00107600         -0.00024400          0.00000000          0.00000000          0.00000000          0.00000000
       1582.00000000          0.00452200         -0.00103100          0.00000000          0.00000000          0.00000000          0.00000000
        516.10000000          0.01610800         -0.00368800          0.00000000          0.00000000          0.00000000          0.00000000
        187.20000000          0.04908500         -0.01151400          0.00000000          0.00000000          0.00000000          0.00000000
         73.93000000          0.12485700         -0.03043500          0.00000000          0.00000000          0.00000000          0.00000000
         31.22000000          0.25168600         -0.06814700          0.00000000          0.00000000          0.00000000          0.00000000
         13.81000000          0.36242000         -0.12036800          0.00000000          0.00000000          0.00000000          0.00000000
          6.25600000          0.27905100         -0.14826000          0.00000000          0.00000000          0.00000000          0.00000000
          2.77600000          0.06355200          0.00990500          1.00000000          0.00000000          0.00000000          0.00000000
          1.13800000          0.00106300          0.38428600          0.00000000          1.00000000          0.00000000          0.00000000
          0.46000000          0.00114400          0.53680500          0.00000000          0.00000000          1.00000000          0.00000000
          0.18290000         -0.00004000          0.20268700          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        195.50000000          0.00091800          0.00000000          0.00000000          0.00000000          0.00000000
         46.16000000          0.00738800          0.00000000          0.00000000          0.00000000          0.00000000
         14.58000000          0.03495800          0.00000000          0.00000000          0.00000000          0.00000000
          5.29600000          0.11543100          0.00000000          0.00000000          0.00000000          0.00000000
          2.09400000          0.25680300          1.00000000          0.00000000          0.00000000          0.00000000
          0.84710000          0.37393800          0.00000000          1.00000000          0.00000000          0.00000000
          0.33680000          0.34344700          0.00000000          0.00000000          1.00000000          0.00000000
          0.12850000          0.12970600          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          5.87900000          1.00000000
  1  2  2  1  1
          2.30700000          1.00000000
  1  2  2  1  1
          0.90500000          1.00000000
  1  2  2  1  1
          0.35500000          1.00000000
  1  3  3  1  1
          4.01600000          1.00000000
  1  3  3  1  1
          1.55400000          1.00000000
  1  3  3  1  1
          0.60100000          1.00000000
  1  4  4  1  1
          3.35000000          1.00000000
  1  4  4  1  1
          1.18900000          1.00000000
  1  5  5  1  1
          2.31900000          1.00000000
  1  0  0  1  1
          0.06550000          1.00000000
  1  1  1  1  1
          0.04460000          1.00000000
  1  2  2  1  1
          0.13100000          1.00000000
  1  3  3  1  1
          0.23700000          1.00000000
  1  4  4  1  1
          0.51700000          1.00000000
  1  5  5  1  1
          1.02400000          1.00000000
# FLUORINE
F  aug-cc-pV5Z
 18
  1  0  0 14  6
     211400.00000000          0.00002600         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      31660.00000000          0.00020100         -0.00004700          0.00000000          0.00000000          0.00000000          0.00000000
       7202.00000000          0.00105600         -0.00024400          0.00000000          0.00000000          0.00000000          0.00000000
       2040.00000000          0.00443200         -0.00103100          0.00000000          0.00000000          0.00000000          0.00000000
        666.40000000          0.01576600         -0.00368300          0.00000000          0.00000000          0.00000000          0.00000000
        242.00000000          0.04811200         -0.01151300          0.00000000          0.00000000          0.00000000          0.00000000
         95.53000000          0.12323200         -0.03066300          0.00000000          0.00000000          0.00000000          0.00000000
         40.23000000          0.25151900         -0.06957200          0.00000000          0.00000000          0.00000000          0.00000000
         17.72000000          0.36452500         -0.12399200          0.00000000          0.00000000          0.00000000          0.00000000
          8.00500000          0.27976600         -0.15021400          0.00000000          0.00000000          0.00000000          0.00000000
          3.53800000          0.06354500          0.01646000          1.00000000          0.00000000          0.00000000          0.00000000
          1.45800000          0.00111100          0.39255000          0.00000000          1.00000000          0.00000000          0.00000000
          0.58870000          0.00125800          0.53216400          0.00000000          0.00000000          1.00000000          0.00000000
          0.23240000         -0.00003500          0.19652400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        241.90000000          0.00100200          0.00000000          0.00000000          0.00000000          0.00000000
         57.17000000          0.00805400          0.00000000          0.00000000          0.00000000          0.00000000
         18.13000000          0.03804800          0.00000000          0.00000000          0.00000000          0.00000000
          6.62400000          0.12377900          0.00000000          0.00000000          0.00000000          0.00000000
          2.62200000          0.26606000          1.00000000          0.00000000          0.00000000          0.00000000
          1.05700000          0.37179600          0.00000000          1.00000000          0.00000000          0.00000000
          0.41760000          0.33289000          0.00000000          0.00000000          1.00000000          0.00000000
          0.15740000          0.12849100          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          7.76000000          1.00000000
  1  2  2  1  1
          3.03200000          1.00000000
  1  2  2  1  1
          1.18500000          1.00000000
  1  2  2  1  1
          0.46300000          1.00000000
  1  3  3  1  1
          5.39800000          1.00000000
  1  3  3  1  1
          2.07800000          1.00000000
  1  3  3  1  1
          0.80000000          1.00000000
  1  4  4  1  1
          4.33800000          1.00000000
  1  4  4  1  1
          1.51300000          1.00000000
  1  5  5  1  1
          2.99500000          1.00000000
  1  0  0  1  1
          0.08060000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  2  2  1  1
          0.17200000          1.00000000
  1  3  3  1  1
          0.33100000          1.00000000
  1  4  4  1  1
          0.66300000          1.00000000
  1  5  5  1  1
          1.32600000          1.00000000
# NEON
Ne aug-cc-pV5Z
 18
  1  0  0 14  6
     262700.00000000          0.00002600         -0.00000600          0.00000000          0.00000000          0.00000000          0.00000000
      39350.00000000          0.00020000         -0.00004700          0.00000000          0.00000000          0.00000000          0.00000000
       8955.00000000          0.00105000         -0.00024700          0.00000000          0.00000000          0.00000000          0.00000000
       2538.00000000          0.00440000         -0.00103800          0.00000000          0.00000000          0.00000000          0.00000000
        829.90000000          0.01564900         -0.00371100          0.00000000          0.00000000          0.00000000          0.00000000
        301.50000000          0.04775800         -0.01159300          0.00000000          0.00000000          0.00000000          0.00000000
        119.00000000          0.12294300         -0.03108600          0.00000000          0.00000000          0.00000000          0.00000000
         50.00000000          0.25248300         -0.07097200          0.00000000          0.00000000          0.00000000          0.00000000
         21.98000000          0.36631400         -0.12726600          0.00000000          0.00000000          0.00000000          0.00000000
          9.89100000          0.27961700         -0.15123100          0.00000000          0.00000000          0.00000000          0.00000000
          4.32700000          0.06165100          0.02466600          1.00000000          0.00000000          0.00000000          0.00000000
          1.80400000          0.00093400          0.39961200          0.00000000          1.00000000          0.00000000          0.00000000
          0.72880000          0.00136700          0.52661600          0.00000000          0.00000000          1.00000000          0.00000000
          0.28670000         -0.00003800          0.19085400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1  8  5
        299.10000000          0.00103800          0.00000000          0.00000000          0.00000000          0.00000000
         70.73000000          0.00837500          0.00000000          0.00000000          0.00000000          0.00000000
         22.48000000          0.03969300          0.00000000          0.00000000          0.00000000          0.00000000
          8.24600000          0.12805600          0.00000000          0.00000000          0.00000000          0.00000000
          3.26900000          0.27032500          1.00000000          0.00000000          0.00000000          0.00000000
          1.31500000          0.37096300          0.00000000          1.00000000          0.00000000          0.00000000
          0.51580000          0.32849900          0.00000000          0.00000000          1.00000000          0.00000000
          0.19180000          0.12758800          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          9.83700000          1.00000000
  1  2  2  1  1
          3.84400000          1.00000000
  1  2  2  1  1
          1.50200000          1.00000000
  1  2  2  1  1
          0.58700000          1.00000000
  1  3  3  1  1
          7.09000000          1.00000000
  1  3  3  1  1
          2.73800000          1.00000000
  1  3  3  1  1
          1.05700000          1.00000000
  1  4  4  1  1
          5.46000000          1.00000000
  1  4  4  1  1
          1.88000000          1.00000000
  1  5  5  1  1
          3.77600000          1.00000000
  1  0  0  1  1
          0.09570000          1.00000000
  1  1  1  1  1
          0.06540000          1.00000000
  1  2  2  1  1
          0.21300000          1.00000000
  1  3  3  1  1
          0.42500000          1.00000000
  1  4  4  1  1
          0.80900000          1.00000000
  1  5  5  1  1
          1.62800000          1.00000000
# ALUMINUM
Al aug-cc-pV5Z
 18
  1  0  0 20  7
    3269000.00000000          0.00000214         -0.00000056          0.00000013          0.00000000          0.00000000          0.00000000          0.00000000
     489400.00000000          0.00001663         -0.00000432          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000
     111400.00000000          0.00008752         -0.00002274          0.00000525          0.00000000          0.00000000          0.00000000          0.00000000
      31560.00000000          0.00036899         -0.00009601          0.00002214          0.00000000          0.00000000          0.00000000          0.00000000
      10320.00000000          0.00133903         -0.00034838          0.00008055          0.00000000          0.00000000          0.00000000          0.00000000
       3731.00000000          0.00435636         -0.00113836          0.00026251          0.00000000          0.00000000          0.00000000          0.00000000
       1456.00000000          0.01289550         -0.00338744          0.00078422          0.00000000          0.00000000          0.00000000          0.00000000
        604.10000000          0.03482010         -0.00931505          0.00215039          0.00000000          0.00000000          0.00000000          0.00000000
        263.50000000          0.08435300         -0.02330230          0.00541974          0.00000000          0.00000000          0.00000000          0.00000000
        119.80000000          0.17590700         -0.05234860          0.01216860          0.00000000          0.00000000          0.00000000          0.00000000
         56.32000000          0.29209100         -0.09994990          0.02368230          0.00000000          0.00000000          0.00000000          0.00000000
         27.19000000          0.32822000         -0.15056000          0.03609370          0.00000000          0.00000000          0.00000000          0.00000000
         13.26000000          0.18692700         -0.11912100          0.03032840          0.00000000          0.00000000          0.00000000          0.00000000
          6.05200000          0.03104300          0.10809100         -0.03090340          0.00000000          0.00000000          0.00000000          0.00000000
          2.98100000         -0.00050892          0.41112900         -0.11912600          0.00000000          0.00000000          0.00000000          0.00000000
          1.47600000          0.00148836          0.45721400         -0.21114500          0.00000000          0.00000000          0.00000000          0.00000000
          0.73340000         -0.00027824          0.17593800         -0.15794400          1.00000000          0.00000000          0.00000000          0.00000000
          0.24470000          0.00011875          0.00770610          0.33903800          0.00000000          1.00000000          0.00000000          0.00000000
          0.10880000         -0.00006615         -0.00166168          0.61309700          0.00000000          0.00000000          1.00000000          0.00000000
          0.04672000          0.00001760          0.00044535          0.23516800          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       1461.00000000          0.00020861         -0.00003719          0.00000000          0.00000000          0.00000000          0.00000000
        346.20000000          0.00181005         -0.00032856          0.00000000          0.00000000          0.00000000          0.00000000
        112.20000000          0.00973433         -0.00174264          0.00000000          0.00000000          0.00000000          0.00000000
         42.51000000          0.03782660         -0.00694828          0.00000000          0.00000000          0.00000000          0.00000000
         17.72000000          0.11089800         -0.02028070          0.00000000          0.00000000          0.00000000          0.00000000
          7.85200000          0.23429500         -0.04486570          0.00000000          0.00000000          0.00000000          0.00000000
          3.57100000          0.34524500         -0.06432780          0.00000000          0.00000000          0.00000000          0.00000000
          1.63700000          0.33143000         -0.07526660          0.00000000          0.00000000          0.00000000          0.00000000
          0.73820000          0.14706400          0.00061601          1.00000000          0.00000000          0.00000000          0.00000000
          0.25770000          0.01214110          0.28781900          0.00000000          1.00000000          0.00000000          0.00000000
          0.09773000         -0.00087164          0.54303000          0.00000000          0.00000000          1.00000000          0.00000000
          0.03690000          0.00043796          0.30186500          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          1.31700000          1.00000000
  1  2  2  1  1
          0.52600000          1.00000000
  1  2  2  1  1
          0.21000000          1.00000000
  1  2  2  1  1
          0.08400000          1.00000000
  1  3  3  1  1
          0.13000000          1.00000000
  1  3  3  1  1
          0.25800000          1.00000000
  1  3  3  1  1
          0.51300000          1.00000000
  1  4  4  1  1
          0.25200000          1.00000000
  1  4  4  1  1
          0.54300000          1.00000000
  1  5  5  1  1
          0.44600000          1.00000000
  1  0  0  1  1
          0.01770000          1.00000000
  1  1  1  1  1
          0.01150000          1.00000000
  1  2  2  1  1
          0.02940000          1.00000000
  1  3  3  1  1
          0.05090000          1.00000000
  1  4  4  1  1
          0.10690000          1.00000000
  1  5  5  1  1
          0.22700000          1.00000000
# SILICON
Si aug-cc-pV5Z
 18
  1  0  0 20  7
    3948000.00000000          0.00000204         -0.00000054          0.00000014          0.00000000          0.00000000          0.00000000          0.00000000
     591100.00000000          0.00001584         -0.00000422          0.00000108          0.00000000          0.00000000          0.00000000          0.00000000
     134500.00000000          0.00008336         -0.00002218          0.00000569          0.00000000          0.00000000          0.00000000          0.00000000
      38120.00000000          0.00035136         -0.00009360          0.00002395          0.00000000          0.00000000          0.00000000          0.00000000
      12460.00000000          0.00127660         -0.00034012          0.00008724          0.00000000          0.00000000          0.00000000          0.00000000
       4504.00000000          0.00415191         -0.00111061          0.00028416          0.00000000          0.00000000          0.00000000          0.00000000
       1758.00000000          0.01230300         -0.00330878          0.00084984          0.00000000          0.00000000          0.00000000          0.00000000
        729.10000000          0.03331020         -0.00911602          0.00233527          0.00000000          0.00000000          0.00000000          0.00000000
        318.00000000          0.08098450         -0.02287900          0.00590466          0.00000000          0.00000000          0.00000000          0.00000000
        144.60000000          0.17029000         -0.05171190          0.01334610          0.00000000          0.00000000          0.00000000          0.00000000
         67.97000000          0.28687900         -0.09990910          0.02628890          0.00000000          0.00000000          0.00000000          0.00000000
         32.82000000          0.33034000         -0.15274700          0.04074260          0.00000000          0.00000000          0.00000000          0.00000000
         16.03000000          0.19660200         -0.12750800          0.03614760          0.00000000          0.00000000          0.00000000          0.00000000
          7.39600000          0.03545350          0.09469630         -0.03039230          0.00000000          0.00000000          0.00000000          0.00000000
          3.66100000         -0.00053520          0.41403600         -0.13596100          0.00000000          0.00000000          0.00000000          0.00000000
          1.82300000          0.00161465          0.46793400         -0.25014400          0.00000000          0.00000000          0.00000000          0.00000000
          0.91470000         -0.00037274          0.17392700         -0.15805000          1.00000000          0.00000000          0.00000000          0.00000000
          0.33930000          0.00014623          0.00843895          0.36965500          0.00000000          1.00000000          0.00000000          0.00000000
          0.15000000         -0.00007894         -0.00099807          0.61771800          0.00000000          0.00000000          1.00000000          0.00000000
          0.06438000          0.00001928          0.00036210          0.22251400          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       1780.00000000          0.00020121         -0.00004272          0.00000000          0.00000000          0.00000000          0.00000000
        421.80000000          0.00174937         -0.00037704          0.00000000          0.00000000          0.00000000          0.00000000
        136.70000000          0.00948141         -0.00202240          0.00000000          0.00000000          0.00000000          0.00000000
         51.81000000          0.03723130         -0.00812833          0.00000000          0.00000000          0.00000000          0.00000000
         21.60000000          0.11076300         -0.02422720          0.00000000          0.00000000          0.00000000          0.00000000
          9.56300000          0.23793300         -0.05438250          0.00000000          0.00000000          0.00000000          0.00000000
          4.35000000          0.35369100         -0.07990510          0.00000000          0.00000000          0.00000000          0.00000000
          2.00600000          0.32883900         -0.08889580          0.00000000          0.00000000          0.00000000          0.00000000
          0.92050000          0.13237300          0.01839970          1.00000000          0.00000000          0.00000000          0.00000000
          0.35000000          0.01033000          0.33509600          0.00000000          1.00000000          0.00000000          0.00000000
          0.13810000         -0.00015030          0.53228800          0.00000000          0.00000000          1.00000000          0.00000000
          0.05338000          0.00026581          0.25437400          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.12600000          1.00000000
  1  2  2  1  1
          0.32100000          1.00000000
  1  2  2  1  1
          0.81700000          1.00000000
  1  2  2  1  1
          2.08200000          1.00000000
  1  3  3  1  1
          0.16900000          1.00000000
  1  3  3  1  1
          0.34100000          1.00000000
  1  3  3  1  1
          0.68800000          1.00000000
  1  4  4  1  1
          0.32000000          1.00000000
  1  4  4  1  1
          0.70500000          1.00000000
  1  5  5  1  1
          0.58300000          1.00000000
  1  0  0  1  1
          0.02600000          1.00000000
  1  1  1  1  1
          0.01920000          1.00000000
  1  2  2  1  1
          0.04680000          1.00000000
  1  3  3  1  1
          0.07350000          1.00000000
  1  4  4  1  1
          0.15100000          1.00000000
  1  5  5  1  1
          0.32300000          1.00000000
# PHOSPHOROUS
P  aug-cc-pV5Z
 18
  1  0  0 20  7
    4666000.00000000          0.00000197         -0.00000053          0.00000015          0.00000000          0.00000000          0.00000000          0.00000000
     698600.00000000          0.00001530         -0.00000415          0.00000114          0.00000000          0.00000000          0.00000000          0.00000000
     159000.00000000          0.00008048         -0.00002185          0.00000601          0.00000000          0.00000000          0.00000000          0.00000000
      45040.00000000          0.00033974         -0.00009233          0.00002534          0.00000000          0.00000000          0.00000000          0.00000000
      14720.00000000          0.00123291         -0.00033511          0.00009216          0.00000000          0.00000000          0.00000000          0.00000000
       5323.00000000          0.00401345         -0.00109508          0.00030056          0.00000000          0.00000000          0.00000000          0.00000000
       2076.00000000          0.01191240         -0.00326798          0.00089988          0.00000000          0.00000000          0.00000000          0.00000000
        861.10000000          0.03225110         -0.00899951          0.00247354          0.00000000          0.00000000          0.00000000          0.00000000
        375.70000000          0.07866430         -0.02265280          0.00626812          0.00000000          0.00000000          0.00000000          0.00000000
        170.80000000          0.16645800         -0.05146500          0.01425980          0.00000000          0.00000000          0.00000000          0.00000000
         80.29000000          0.28303900         -0.10018600          0.02827690          0.00000000          0.00000000          0.00000000          0.00000000
         38.77000000          0.33194200         -0.15507500          0.04451240          0.00000000          0.00000000          0.00000000          0.00000000
         18.93000000          0.20335200         -0.13381800          0.04072170          0.00000000          0.00000000          0.00000000          0.00000000
          8.79600000          0.03831830          0.08783610         -0.03019080          0.00000000          0.00000000          0.00000000          0.00000000
          4.35800000         -0.00038472          0.42258100         -0.15289400          0.00000000          0.00000000          0.00000000          0.00000000
          2.17400000          0.00158744          0.47489900         -0.28241100          0.00000000          0.00000000          0.00000000          0.00000000
          1.09500000         -0.00041338          0.16500200         -0.14852200          1.00000000          0.00000000          0.00000000          0.00000000
          0.44000000          0.00015284          0.00846862          0.39356300          0.00000000          1.00000000          0.00000000          0.00000000
          0.19450000         -0.00008270         -0.00029176          0.61732700          0.00000000          0.00000000          1.00000000          0.00000000
          0.08376000          0.00001841          0.00028534          0.21461200          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2010.00000000          0.00021592         -0.00005114          0.00000000          0.00000000          0.00000000          0.00000000
        476.30000000          0.00187536         -0.00044836          0.00000000          0.00000000          0.00000000          0.00000000
        154.40000000          0.01017420         -0.00242340          0.00000000          0.00000000          0.00000000          0.00000000
         58.51000000          0.03998560         -0.00969826          0.00000000          0.00000000          0.00000000          0.00000000
         24.40000000          0.11856300         -0.02909650          0.00000000          0.00000000          0.00000000          0.00000000
         10.80000000          0.25181600         -0.06417260          0.00000000          0.00000000          0.00000000          0.00000000
          4.91300000          0.36656500         -0.09450710          0.00000000          0.00000000          0.00000000          0.00000000
          2.26900000          0.31617700         -0.09347000          0.00000000          0.00000000          0.00000000          0.00000000
          1.04300000          0.10470000          0.05206110          1.00000000          0.00000000          0.00000000          0.00000000
          0.43130000          0.00609862          0.37462400          0.00000000          1.00000000          0.00000000          0.00000000
          0.17670000          0.00050208          0.50909700          0.00000000          0.00000000          1.00000000          0.00000000
          0.07009000         -0.00002956          0.21511600          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.16600000          1.00000000
  1  2  2  1  1
          0.41800000          1.00000000
  1  2  2  1  1
          1.05400000          1.00000000
  1  2  2  1  1
          2.65600000          1.00000000
  1  3  3  1  1
          0.21900000          1.00000000
  1  3  3  1  1
          0.45000000          1.00000000
  1  3  3  1  1
          0.92300000          1.00000000
  1  4  4  1  1
          0.41200000          1.00000000
  1  4  4  1  1
          0.90300000          1.00000000
  1  5  5  1  1
          0.74500000          1.00000000
  1  0  0  1  1
          0.03350000          1.00000000
  1  1  1  1  1
          0.02530000          1.00000000
  1  2  2  1  1
          0.06240000          1.00000000
  1  3  3  1  1
          0.09500000          1.00000000
  1  4  4  1  1
          0.18400000          1.00000000
  1  5  5  1  1
          0.37200000          1.00000000
# SULFUR
S  aug-cc-pV5Z
 18
  1  0  0 20  7
    5481000.00000000          0.00000189         -0.00000052          0.00000015          0.00000000          0.00000000          0.00000000          0.00000000
     820600.00000000          0.00001472         -0.00000407          0.00000118          0.00000000          0.00000000          0.00000000          0.00000000
     186700.00000000          0.00007751         -0.00002141          0.00000622          0.00000000          0.00000000          0.00000000          0.00000000
      52880.00000000          0.00032722         -0.00009045          0.00002624          0.00000000          0.00000000          0.00000000          0.00000000
      17250.00000000          0.00119365         -0.00033008          0.00009590          0.00000000          0.00000000          0.00000000          0.00000000
       6226.00000000          0.00388393         -0.00107782          0.00031268          0.00000000          0.00000000          0.00000000          0.00000000
       2429.00000000          0.01153360         -0.00321874          0.00093632          0.00000000          0.00000000          0.00000000          0.00000000
       1007.00000000          0.03127480         -0.00887217          0.00257790          0.00000000          0.00000000          0.00000000          0.00000000
        439.50000000          0.07643870         -0.02237710          0.00654121          0.00000000          0.00000000          0.00000000          0.00000000
        199.80000000          0.16270000         -0.05105770          0.01496300          0.00000000          0.00000000          0.00000000          0.00000000
         93.92000000          0.27932800         -0.10022500          0.02989400          0.00000000          0.00000000          0.00000000          0.00000000
         45.34000000          0.33314500         -0.15679500          0.04769460          0.00000000          0.00000000          0.00000000          0.00000000
         22.15000000          0.20983600         -0.13974800          0.04495560          0.00000000          0.00000000          0.00000000          0.00000000
         10.34000000          0.04159740          0.08100590         -0.02930090          0.00000000          0.00000000          0.00000000          0.00000000
          5.11900000         -0.00045055          0.43088300         -0.16891600          0.00000000          0.00000000          0.00000000          0.00000000
          2.55300000          0.00168855          0.48168800         -0.31101400          0.00000000          0.00000000          0.00000000          0.00000000
          1.28200000         -0.00051724          0.15686200         -0.13649100          1.00000000          0.00000000          0.00000000          0.00000000
          0.54500000          0.00018877          0.00788814          0.42319500          0.00000000          1.00000000          0.00000000          0.00000000
          0.24110000         -0.00009977          0.00039353          0.61388800          0.00000000          0.00000000          1.00000000          0.00000000
          0.10350000          0.00002090          0.00022376          0.20047300          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2200.00000000          0.00023905         -0.00006086          0.00000000          0.00000000          0.00000000          0.00000000
        521.40000000          0.00207686         -0.00053042          0.00000000          0.00000000          0.00000000          0.00000000
        169.00000000          0.01123630         -0.00287915          0.00000000          0.00000000          0.00000000          0.00000000
         64.05000000          0.04406900         -0.01143970          0.00000000          0.00000000          0.00000000          0.00000000
         26.72000000          0.12916800         -0.03427640          0.00000000          0.00000000          0.00000000          0.00000000
         11.83000000          0.26908300         -0.07358110          0.00000000          0.00000000          0.00000000          0.00000000
          5.37800000          0.37861100         -0.10778200          0.00000000          0.00000000          0.00000000          0.00000000
          2.48200000          0.29677900         -0.08797690          0.00000000          0.00000000          0.00000000          0.00000000
          1.11600000          0.07796760          0.10826100          1.00000000          0.00000000          0.00000000          0.00000000
          0.48480000          0.00205193          0.40708200          0.00000000          1.00000000          0.00000000          0.00000000
          0.20060000          0.00143602          0.46899400          0.00000000          0.00000000          1.00000000          0.00000000
          0.07951000         -0.00005960          0.18487700          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.20500000          1.00000000
  1  2  2  1  1
          0.51200000          1.00000000
  1  2  2  1  1
          1.28100000          1.00000000
  1  2  2  1  1
          3.20300000          1.00000000
  1  3  3  1  1
          0.25500000          1.00000000
  1  3  3  1  1
          0.52900000          1.00000000
  1  3  3  1  1
          1.09600000          1.00000000
  1  4  4  1  1
          0.46300000          1.00000000
  1  4  4  1  1
          1.07100000          1.00000000
  1  5  5  1  1
          0.87200000          1.00000000
  1  0  0  1  1
          0.04200000          1.00000000
  1  1  1  1  1
          0.02940000          1.00000000
  1  2  2  1  1
          0.07940000          1.00000000
  1  3  3  1  1
          0.11880000          1.00000000
  1  4  4  1  1
          0.22000000          1.00000000
  1  5  5  1  1
          0.47200000          1.00000000
# CHLORINE
Cl aug-cc-pV5Z
 18
  1  0  0 20  7
    6410000.00000000          0.00000181         -0.00000051          0.00000015          0.00000000          0.00000000          0.00000000          0.00000000
     959600.00000000          0.00001411         -0.00000396          0.00000120          0.00000000          0.00000000          0.00000000          0.00000000
     218300.00000000          0.00007424         -0.00002081          0.00000630          0.00000000          0.00000000          0.00000000          0.00000000
      61810.00000000          0.00031413         -0.00008812          0.00002664          0.00000000          0.00000000          0.00000000          0.00000000
      20140.00000000          0.00114642         -0.00032174          0.00009742          0.00000000          0.00000000          0.00000000          0.00000000
       7264.00000000          0.00373888         -0.00105277          0.00031836          0.00000000          0.00000000          0.00000000          0.00000000
       2832.00000000          0.01109460         -0.00314183          0.00095238          0.00000000          0.00000000          0.00000000          0.00000000
       1175.00000000          0.03011520         -0.00866363          0.00262430          0.00000000          0.00000000          0.00000000          0.00000000
        512.60000000          0.07391450         -0.02193530          0.00668160          0.00000000          0.00000000          0.00000000          0.00000000
        233.00000000          0.15825800         -0.05025840          0.01535950          0.00000000          0.00000000          0.00000000          0.00000000
        109.50000000          0.27475300         -0.09954140          0.03094320          0.00000000          0.00000000          0.00000000          0.00000000
         52.86000000          0.33406600         -0.15764700          0.05006380          0.00000000          0.00000000          0.00000000          0.00000000
         25.84000000          0.21758900         -0.14602400          0.04897820          0.00000000          0.00000000          0.00000000          0.00000000
         12.17000000          0.04572780          0.06922300         -0.02608070          0.00000000          0.00000000          0.00000000          0.00000000
          6.03000000         -0.00013474          0.43041200         -0.17842600          0.00000000          0.00000000          0.00000000          0.00000000
          3.01200000          0.00163933          0.49080200         -0.33232400          0.00000000          0.00000000          0.00000000          0.00000000
          1.51100000         -0.00052221          0.15839000         -0.13200800          1.00000000          0.00000000          0.00000000          0.00000000
          0.66040000          0.00018065          0.00839885          0.44055600          0.00000000          1.00000000          0.00000000          0.00000000
          0.29260000         -0.00009993          0.00076848          0.61189100          0.00000000          0.00000000          1.00000000          0.00000000
          0.12540000          0.00001922          0.00022715          0.19317200          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2548.00000000          0.00023570         -0.00006354          0.00000000          0.00000000          0.00000000          0.00000000
        603.70000000          0.00205158         -0.00055326          0.00000000          0.00000000          0.00000000          0.00000000
        195.60000000          0.01115430         -0.00302795          0.00000000          0.00000000          0.00000000          0.00000000
         74.15000000          0.04398160         -0.01206500          0.00000000          0.00000000          0.00000000          0.00000000
         30.94000000          0.12999400         -0.03663480          0.00000000          0.00000000          0.00000000          0.00000000
         13.69000000          0.27295900         -0.07907640          0.00000000          0.00000000          0.00000000          0.00000000
          6.22900000          0.38369000         -0.11742200          0.00000000          0.00000000          0.00000000          0.00000000
          2.87800000          0.29187000         -0.08609430          0.00000000          0.00000000          0.00000000          0.00000000
          1.28200000          0.07044640          0.14030800          1.00000000          0.00000000          0.00000000          0.00000000
          0.56410000          0.00128761          0.42233600          0.00000000          1.00000000          0.00000000          0.00000000
          0.23480000          0.00182623          0.44636300          0.00000000          0.00000000          1.00000000          0.00000000
          0.09312000          0.00001990          0.16663400          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.61800000          1.00000000
  1  2  2  1  1
          1.52900000          1.00000000
  1  2  2  1  1
          3.78100000          1.00000000
  1  3  3  1  1
          0.32000000          1.00000000
  1  3  3  1  1
          0.65600000          1.00000000
  1  3  3  1  1
          1.34500000          1.00000000
  1  4  4  1  1
          0.55600000          1.00000000
  1  4  4  1  1
          1.30200000          1.00000000
  1  5  5  1  1
          1.05300000          1.00000000
  1  0  0  1  1
          0.04790000          1.00000000
  1  1  1  1  1
          0.03480000          1.00000000
  1  2  2  1  1
          0.10030000          1.00000000
  1  3  3  1  1
          0.16400000          1.00000000
  1  4  4  1  1
          0.27700000          1.00000000
  1  5  5  1  1
          0.60700000          1.00000000
# ARGON
Ar aug-cc-pV5Z
 18
  1  0  0 20  7
    7401000.00000000          0.00000175         -0.00000050          0.00000016          0.00000000          0.00000000          0.00000000          0.00000000
    1108000.00000000          0.00001361         -0.00000387          0.00000121          0.00000000          0.00000000          0.00000000          0.00000000
     252100.00000000          0.00007163         -0.00002034          0.00000636          0.00000000          0.00000000          0.00000000          0.00000000
      71380.00000000          0.00030303         -0.00008609          0.00002689          0.00000000          0.00000000          0.00000000          0.00000000
      23260.00000000          0.00110608         -0.00031444          0.00009834          0.00000000          0.00000000          0.00000000          0.00000000
       8390.00000000          0.00360671         -0.00102841          0.00032129          0.00000000          0.00000000          0.00000000          0.00000000
       3271.00000000          0.01071321         -0.00307267          0.00096200          0.00000000          0.00000000          0.00000000          0.00000000
       1357.00000000          0.02910677         -0.00847532          0.00265245          0.00000000          0.00000000          0.00000000          0.00000000
        592.00000000          0.07166011         -0.02152008          0.00677035          0.00000000          0.00000000          0.00000000          0.00000000
        269.10000000          0.15414053         -0.04944932          0.01561727          0.00000000          0.00000000          0.00000000          0.00000000
        126.50000000          0.27041707         -0.09877592          0.03171666          0.00000000          0.00000000          0.00000000          0.00000000
         61.03000000          0.33485470         -0.15830822          0.05199742          0.00000000          0.00000000          0.00000000          0.00000000
         29.86000000          0.22434631         -0.15140298          0.05247514          0.00000000          0.00000000          0.00000000          0.00000000
         14.17000000          0.05000284          0.05824264         -0.02264147          0.00000000          0.00000000          0.00000000          0.00000000
          7.02200000          0.00006459          0.42938305         -0.18606229          0.00000000          0.00000000          0.00000000          0.00000000
          3.51100000          0.00168641          0.49908884         -0.35014547          0.00000000          0.00000000          0.00000000          0.00000000
          1.75800000         -0.00058096          0.16027837         -0.12768281          1.00000000          0.00000000          0.00000000          0.00000000
          0.78410000          0.00019670          0.00883960          0.45334533          0.00000000          1.00000000          0.00000000          0.00000000
          0.34800000         -0.00011125          0.00113130          0.60988242          0.00000000          0.00000000          1.00000000          0.00000000
          0.14910000          0.00002061          0.00022377          0.18809921          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 12  6
       2927.00000000          0.00023199         -0.00006491          0.00000000          0.00000000          0.00000000          0.00000000
        693.50000000          0.00202329         -0.00056531          0.00000000          0.00000000          0.00000000          0.00000000
        224.70000000          0.01103401         -0.00310988          0.00000000          0.00000000          0.00000000          0.00000000
         85.17000000          0.04383970         -0.01246964          0.00000000          0.00000000          0.00000000          0.00000000
         35.53000000          0.13035904         -0.03822465          0.00000000          0.00000000          0.00000000          0.00000000
         15.73000000          0.27574991         -0.08307918          0.00000000          0.00000000          0.00000000          0.00000000
          7.16500000          0.38764330         -0.12459409          0.00000000          0.00000000          0.00000000          0.00000000
          3.32200000          0.28740741         -0.08329713          0.00000000          0.00000000          0.00000000          0.00000000
          1.47800000          0.06575812          0.16398246          1.00000000          0.00000000          0.00000000          0.00000000
          0.65520000          0.00014739          0.43143123          0.00000000          1.00000000          0.00000000          0.00000000
          0.27510000          0.00113879          0.42904059          0.00000000          0.00000000          1.00000000          0.00000000
          0.10970000         -0.00025253          0.15400104          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.30900000          1.00000000
  1  2  2  1  1
          0.77000000          1.00000000
  1  2  2  1  1
          1.91700000          1.00000000
  1  2  2  1  1
          4.77600000          1.00000000
  1  3  3  1  1
          0.40800000          1.00000000
  1  3  3  1  1
          0.82500000          1.00000000
  1  3  3  1  1
          1.66800000          1.00000000
  1  4  4  1  1
          0.66500000          1.00000000
  1  4  4  1  1
          1.56200000          1.00000000
  1  5  5  1  1
          1.26400000          1.00000000
  1  0  0  1  1
          0.05380000          1.00000000
  1  1  1  1  1
          0.04020000          1.00000000
  1  2  2  1  1
          0.12100000          1.00000000
  1  3  3  1  1
          0.20900000          1.00000000
  1  4  4  1  1
          0.33400000          1.00000000
  1  5  5  1  1
          0.74200000          1.00000000
# GALLIUM
Ga aug-cc-pV5Z
 16
  1  0  0 26  8
  108615220.00000000          0.00000024         -0.00000007          0.00000003         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   16264540.00000000          0.00000186         -0.00000058          0.00000022         -0.00000005          0.00000000          0.00000000          0.00000000          0.00000000
    3700111.60000000          0.00000980         -0.00000303          0.00000116         -0.00000027          0.00000000          0.00000000          0.00000000          0.00000000
    1047169.10000000          0.00004152         -0.00001287          0.00000491         -0.00000114          0.00000000          0.00000000          0.00000000          0.00000000
     341067.57000000          0.00015205         -0.00004714          0.00001798         -0.00000418          0.00000000          0.00000000          0.00000000          0.00000000
     122771.54000000          0.00050077         -0.00015530          0.00005920         -0.00001378          0.00000000          0.00000000          0.00000000          0.00000000
      47659.57800000          0.00151870         -0.00047180          0.00018010         -0.00004188          0.00000000          0.00000000          0.00000000          0.00000000
      19633.35400000          0.00430250         -0.00134050          0.00051140         -0.00011902          0.00000000          0.00000000          0.00000000          0.00000000
       8488.73470000          0.01145230         -0.00359550          0.00137400         -0.00031960          0.00000000          0.00000000          0.00000000          0.00000000
       3823.13810000          0.02856400         -0.00910160          0.00348180         -0.00081070          0.00000000          0.00000000          0.00000000          0.00000000
       1784.47550000          0.06574850         -0.02163600          0.00831690         -0.00193600          0.00000000          0.00000000          0.00000000          0.00000000
        860.05305000          0.13528950         -0.04733650          0.01831800         -0.00427220          0.00000000          0.00000000          0.00000000          0.00000000
        426.69867000          0.23455140         -0.09249970          0.03639030         -0.00849450          0.00000000          0.00000000          0.00000000          0.00000000
        217.26161000          0.30783510         -0.15043510          0.06080830         -0.01427090          0.00000000          0.00000000          0.00000000          0.00000000
        112.96987000          0.25299470         -0.17212270          0.07329390         -0.01726810          0.00000000          0.00000000          0.00000000          0.00000000
         59.44944100          0.09601040         -0.04401790          0.01974160         -0.00477820          0.00000000          0.00000000          0.00000000          0.00000000
         30.78225600          0.00978850          0.29738280         -0.16129700          0.03949270          0.00000000          0.00000000          0.00000000          0.00000000
         16.42321200          0.00059120          0.52797480         -0.40219480          0.10272000          0.00000000          0.00000000          0.00000000          0.00000000
          8.75788900         -0.00005540          0.30089050         -0.29272480          0.07735290          0.00000000          0.00000000          0.00000000          0.00000000
          4.40962900          0.00001380          0.04588190          0.27069420         -0.08495650          0.00000000          0.00000000          0.00000000          0.00000000
          2.24944900         -0.00006420          0.00128280          0.63597590         -0.22198340          0.00000000          0.00000000          0.00000000          0.00000000
          1.12611500          0.00001690          0.00125880          0.37024890         -0.25320890          0.00000000          0.00000000          0.00000000          0.00000000
          0.51548600         -0.00001160         -0.00020110          0.04028250         -0.03209540          1.00000000          0.00000000          0.00000000          0.00000000
          0.24257800          0.00000586          0.00011730         -0.00155540          0.43100170          0.00000000          1.00000000          0.00000000          0.00000000
          0.10708600         -0.00000229         -0.00004740          0.00055340          0.57776890          0.00000000          0.00000000          1.00000000          0.00000000
          0.04698800          0.00000061          0.00001120         -0.00007790          0.18148420          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      32152.19000000          0.00002830         -0.00001070          0.00000170          0.00000000          0.00000000          0.00000000          0.00000000
       7609.38420000          0.00025290         -0.00009580          0.00001580          0.00000000          0.00000000          0.00000000          0.00000000
       2471.47440000          0.00146860         -0.00055820          0.00009080          0.00000000          0.00000000          0.00000000          0.00000000
        946.06363000          0.00656270         -0.00250400          0.00041200          0.00000000          0.00000000          0.00000000          0.00000000
        401.94711000          0.02380230         -0.00919960          0.00149840          0.00000000          0.00000000          0.00000000          0.00000000
        183.64688000          0.07089450         -0.02799730          0.00462520          0.00000000          0.00000000          0.00000000          0.00000000
         88.53326400          0.16763840         -0.06887460          0.01127130          0.00000000          0.00000000          0.00000000          0.00000000
         44.27035500          0.29597540         -0.12738430          0.02132120          0.00000000          0.00000000          0.00000000          0.00000000
         22.72308300          0.34886100         -0.15858890          0.02595230          0.00000000          0.00000000          0.00000000          0.00000000
         11.82314100          0.21754960         -0.04249680          0.00663200          0.00000000          0.00000000          0.00000000          0.00000000
          6.04213500          0.05205110          0.24414400         -0.05017040          0.00000000          0.00000000          0.00000000          0.00000000
          3.03175400          0.00343780          0.44591110         -0.08429770          0.00000000          0.00000000          0.00000000          0.00000000
          1.49336600          0.00098330          0.35295220         -0.09030230          0.00000000          0.00000000          0.00000000          0.00000000
          0.70972700          0.00003910          0.10494460          0.01847270          1.00000000          0.00000000          0.00000000          0.00000000
          0.24859300          0.00004490          0.00524990          0.31232250          0.00000000          1.00000000          0.00000000          0.00000000
          0.09439500         -0.00001910         -0.00012190          0.53648160          0.00000000          0.00000000          1.00000000          0.00000000
          0.03588700          0.00000530          0.00012630          0.28316500          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1040.50460000          0.00008920          0.00000000          0.00000000          0.00000000
        314.59714000          0.00086250          0.00000000          0.00000000          0.00000000
        122.78760000          0.00500940          0.00000000          0.00000000          0.00000000
         54.76036900          0.01996490          0.00000000          0.00000000          0.00000000
         26.29894400          0.05832140          0.00000000          0.00000000          0.00000000
         13.26344500          0.13168680          0.00000000          0.00000000          0.00000000
          6.88506500          0.22186760          0.00000000          0.00000000          0.00000000
          3.57952500          0.28250590          0.00000000          0.00000000          0.00000000
          1.83156400          0.28319890          0.00000000          0.00000000          0.00000000
          0.91290900          0.21582510          1.00000000          0.00000000          0.00000000
          0.43534000          0.10524360          0.00000000          1.00000000          0.00000000
          0.18851800          0.02072320          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.07580000          1.00000000
  1  3  3  1  1
          0.13400000          1.00000000
  1  3  3  1  1
          0.28260000          1.00000000
  1  3  3  1  1
          0.59600000          1.00000000
  1  4  4  1  1
          0.27500000          1.00000000
  1  4  4  1  1
          0.61460000          1.00000000
  1  5  5  1  1
          0.49860000          1.00000000
  1  0  0  1  1
          0.01730100          1.00000000
  1  1  1  1  1
          0.01105000          1.00000000
  1  2  2  1  1
          0.02600000          1.00000000
  1  3  3  1  1
          0.05110000          1.00000000
  1  4  4  1  1
          0.11400000          1.00000000
  1  5  5  1  1
          0.25400000          1.00000000
# GERMANIUM
Ge aug-cc-pV5Z
 16
  1  0  0 26  8
  122001190.00000000          0.00000022         -0.00000007          0.00000003         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   18257470.00000000          0.00000175         -0.00000054          0.00000021         -0.00000005          0.00000000          0.00000000          0.00000000          0.00000000
    4150821.50000000          0.00000920         -0.00000286          0.00000110         -0.00000028          0.00000000          0.00000000          0.00000000          0.00000000
    1174101.80000000          0.00003899         -0.00001213          0.00000467         -0.00000112          0.00000000          0.00000000          0.00000000          0.00000000
     382309.15000000          0.00014280         -0.00004443          0.00001713         -0.00000439          0.00000000          0.00000000          0.00000000          0.00000000
     137607.96000000          0.00047030         -0.00014640          0.00005640         -0.00001446          0.00000000          0.00000000          0.00000000          0.00000000
      53419.24200000          0.00142670         -0.00044470          0.00017150         -0.00004396          0.00000000          0.00000000          0.00000000          0.00000000
      22005.75600000          0.00404340         -0.00126370          0.00048720         -0.00012490          0.00000000          0.00000000          0.00000000          0.00000000
       9513.84790000          0.01077320         -0.00339200          0.00130970         -0.00033580          0.00000000          0.00000000          0.00000000          0.00000000
       4284.17560000          0.02692730         -0.00859790          0.00332320         -0.00085250          0.00000000          0.00000000          0.00000000          0.00000000
       1999.16640000          0.06223740         -0.02049640          0.00795910         -0.00204240          0.00000000          0.00000000          0.00000000          0.00000000
        963.24716000          0.12903820         -0.04505710          0.01760970         -0.00452450          0.00000000          0.00000000          0.00000000          0.00000000
        477.80500000          0.22673120         -0.08879220          0.03525760         -0.00907440          0.00000000          0.00000000          0.00000000          0.00000000
        243.31589000          0.30489030         -0.14662990          0.05976870         -0.01544830          0.00000000          0.00000000          0.00000000          0.00000000
        126.63999000          0.26176620         -0.17431400          0.07474060         -0.01943380          0.00000000          0.00000000          0.00000000          0.00000000
         66.78357900          0.10763480         -0.06116560          0.02778630         -0.00732890          0.00000000          0.00000000          0.00000000          0.00000000
         34.41608400          0.01262340          0.27166900         -0.14728780          0.03964850          0.00000000          0.00000000          0.00000000          0.00000000
         18.37281400          0.00039180          0.52802260         -0.39742020          0.11217960          0.00000000          0.00000000          0.00000000          0.00000000
          9.80546100          0.00008120          0.32401380         -0.32056660          0.09356860          0.00000000          0.00000000          0.00000000          0.00000000
          4.96940300         -0.00004890          0.05441770          0.23319680         -0.08064590          0.00000000          0.00000000          0.00000000          0.00000000
          2.54862300         -0.00003170          0.00144630          0.64248900         -0.25011090          0.00000000          0.00000000          0.00000000          0.00000000
          1.28459400         -0.00000109          0.00142480          0.39666840         -0.29780990          0.00000000          0.00000000          0.00000000          0.00000000
          0.58335300         -0.00000297         -0.00028400          0.04476960         -0.02201710          1.00000000          0.00000000          0.00000000          0.00000000
          0.29343900          0.00000185          0.00015850         -0.00260500          0.47231340          0.00000000          1.00000000          0.00000000          0.00000000
          0.13267200         -0.00000054         -0.00006560          0.00093570          0.56922160          0.00000000          0.00000000          1.00000000          0.00000000
          0.05923900          0.00000018          0.00001400         -0.00011330          0.16424980          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      32314.97000000          0.00003160         -0.00001220          0.00000240          0.00000000          0.00000000          0.00000000          0.00000000
       7648.20020000          0.00028200         -0.00010840          0.00002140          0.00000000          0.00000000          0.00000000          0.00000000
       2484.21140000          0.00163530         -0.00063110          0.00012430          0.00000000          0.00000000          0.00000000          0.00000000
        951.00305000          0.00728640         -0.00282430          0.00055890          0.00000000          0.00000000          0.00000000          0.00000000
        404.04833000          0.02629310         -0.01033170          0.00203830          0.00000000          0.00000000          0.00000000          0.00000000
        184.60354000          0.07759430         -0.03121020          0.00620160          0.00000000          0.00000000          0.00000000          0.00000000
         88.96412800          0.18036530         -0.07559540          0.01501060          0.00000000          0.00000000          0.00000000          0.00000000
         44.44774200          0.30953540         -0.13629440          0.02741270          0.00000000          0.00000000          0.00000000          0.00000000
         22.79907500          0.34547520         -0.15901500          0.03177960          0.00000000          0.00000000          0.00000000          0.00000000
         11.83592800          0.19632900         -0.01498050          0.00092280          0.00000000          0.00000000          0.00000000          0.00000000
          6.01129400          0.04090680          0.28682250         -0.06983420          0.00000000          0.00000000          0.00000000          0.00000000
          2.99578400          0.00241970          0.46266560         -0.11196000          0.00000000          0.00000000          0.00000000          0.00000000
          1.46957000          0.00080030          0.31685050         -0.09935650          0.00000000          0.00000000          0.00000000          0.00000000
          0.69068100         -0.00001860          0.06853800          0.05773180          1.00000000          0.00000000          0.00000000          0.00000000
          0.28616000          0.00004180          0.00190910          0.37395740          0.00000000          1.00000000          0.00000000          0.00000000
          0.11774200         -0.00001980          0.00068000          0.51165530          0.00000000          0.00000000          1.00000000          0.00000000
          0.04738500          0.00000470         -0.00007750          0.21535210          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1226.79820000          0.00007630          0.00000000          0.00000000          0.00000000
        371.23223000          0.00074250          0.00000000          0.00000000          0.00000000
        144.89099000          0.00437560          0.00000000          0.00000000          0.00000000
         64.60413000          0.01792570          0.00000000          0.00000000          0.00000000
         31.03973700          0.05392530          0.00000000          0.00000000          0.00000000
         15.64387000          0.12571910          0.00000000          0.00000000          0.00000000
          8.12582200          0.21915660          0.00000000          0.00000000          0.00000000
          4.23976200          0.28606620          0.00000000          0.00000000          0.00000000
          2.18638600          0.28965040          0.00000000          0.00000000          0.00000000
          1.10387100          0.21596980          1.00000000          0.00000000          0.00000000
          0.53381100          0.09761640          0.00000000          1.00000000          0.00000000
          0.23135500          0.01676540          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.09530000          1.00000000
  1  3  3  1  1
          0.16300000          1.00000000
  1  3  3  1  1
          0.32970000          1.00000000
  1  3  3  1  1
          0.67090000          1.00000000
  1  4  4  1  1
          0.31600000          1.00000000
  1  4  4  1  1
          0.70340000          1.00000000
  1  5  5  1  1
          0.58150000          1.00000000
  1  0  0  1  1
          0.02427400          1.00000000
  1  1  1  1  1
          0.01759300          1.00000000
  1  2  2  1  1
          0.03640000          1.00000000
  1  3  3  1  1
          0.07050000          1.00000000
  1  4  4  1  1
          0.14600000          1.00000000
  1  5  5  1  1
          0.32000000          1.00000000
# ARSENIC
As aug-cc-pV5Z
 16
  1  0  0 26  8
  137507530.00000000          0.00000021         -0.00000007          0.00000003         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   20515052.00000000          0.00000163         -0.00000051          0.00000020         -0.00000006          0.00000000          0.00000000          0.00000000          0.00000000
    4648716.40000000          0.00000865         -0.00000270          0.00000105         -0.00000029          0.00000000          0.00000000          0.00000000          0.00000000
    1311264.60000000          0.00003676         -0.00001147          0.00000447         -0.00000123          0.00000000          0.00000000          0.00000000          0.00000000
     426185.86000000          0.00013488         -0.00004210          0.00001640         -0.00000452          0.00000000          0.00000000          0.00000000          0.00000000
     153237.06000000          0.00044460         -0.00013880          0.00005404         -0.00001488          0.00000000          0.00000000          0.00000000          0.00000000
      59459.40400000          0.00134880         -0.00042180          0.00016430         -0.00004527          0.00000000          0.00000000          0.00000000          0.00000000
      24492.81200000          0.00382310         -0.00119840          0.00046690         -0.00012858          0.00000000          0.00000000          0.00000000          0.00000000
      10590.25300000          0.01019080         -0.00321740          0.00125520         -0.00034580          0.00000000          0.00000000          0.00000000          0.00000000
       4769.78410000          0.02550270         -0.00815980          0.00318690         -0.00087803          0.00000000          0.00000000          0.00000000          0.00000000
       2226.36980000          0.05911040         -0.01948340          0.00764320         -0.00210730          0.00000000          0.00000000          0.00000000          0.00000000
       1073.08620000          0.12328880         -0.04297870          0.01696690         -0.00468170          0.00000000          0.00000000          0.00000000          0.00000000
        532.50059000          0.21917430         -0.08529870          0.03419090         -0.00945580          0.00000000          0.00000000          0.00000000          0.00000000
        271.29755000          0.30136120         -0.14284020          0.05872870         -0.01629900          0.00000000          0.00000000          0.00000000          0.00000000
        141.31195000          0.26948920         -0.17572820          0.07588560         -0.02121380          0.00000000          0.00000000          0.00000000          0.00000000
         74.58443300          0.11912700         -0.07641270          0.03506140         -0.00989440          0.00000000          0.00000000          0.00000000          0.00000000
         38.29833800          0.01569800          0.24665750         -0.13386230          0.03863790          0.00000000          0.00000000          0.00000000          0.00000000
         20.46913000          0.00020470          0.52538240         -0.39136340          0.11888930          0.00000000          0.00000000          0.00000000          0.00000000
         10.93957800          0.00022360          0.34597240         -0.34628200          0.10889900          0.00000000          0.00000000          0.00000000          0.00000000
          5.59036700         -0.00011680          0.06395330          0.19413270         -0.07220790          0.00000000          0.00000000          0.00000000          0.00000000
          2.88285900          0.00000419          0.00182990          0.64519860         -0.27180000          0.00000000          0.00000000          0.00000000          0.00000000
          1.46608600         -0.00002167          0.00156450          0.42348130         -0.33716620          0.00000000          0.00000000          0.00000000          0.00000000
          0.67483900          0.00000804         -0.00034470          0.05165530         -0.01395500          1.00000000          0.00000000          0.00000000          0.00000000
          0.34639900         -0.00000390          0.00017840         -0.00282610          0.49921120          0.00000000          1.00000000          0.00000000          0.00000000
          0.15928900          0.00000176         -0.00007883          0.00120780          0.56392840          0.00000000          0.00000000          1.00000000          0.00000000
          0.07210900         -0.00000035          0.00001558         -0.00012428          0.15398550          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      34166.16100000          0.00003220         -0.00001260          0.00000280          0.00000000          0.00000000          0.00000000          0.00000000
       8086.56080000          0.00028680         -0.00011190          0.00002490          0.00000000          0.00000000          0.00000000          0.00000000
       2626.51140000          0.00166330         -0.00065160          0.00014510          0.00000000          0.00000000          0.00000000          0.00000000
       1005.39500000          0.00741250         -0.00291730          0.00065040          0.00000000          0.00000000          0.00000000          0.00000000
        427.12735000          0.02675120         -0.01067380          0.00238180          0.00000000          0.00000000          0.00000000          0.00000000
        195.15113000          0.07889440         -0.03224550          0.00722070          0.00000000          0.00000000          0.00000000          0.00000000
         94.05430800          0.18299160         -0.07797310          0.01753180          0.00000000          0.00000000          0.00000000          0.00000000
         46.99988000          0.31249410         -0.14010380          0.03174140          0.00000000          0.00000000          0.00000000          0.00000000
         24.11745700          0.34453220         -0.16071320          0.03654490          0.00000000          0.00000000          0.00000000          0.00000000
         12.51998200          0.19164360         -0.00767030         -0.00160240          0.00000000          0.00000000          0.00000000          0.00000000
          6.35732500          0.03871360          0.30079830         -0.08246440          0.00000000          0.00000000          0.00000000          0.00000000
          3.16805200          0.00224180          0.47158780         -0.13443720          0.00000000          0.00000000          0.00000000          0.00000000
          1.55348100          0.00072090          0.30320640         -0.10516860          0.00000000          0.00000000          0.00000000          0.00000000
          0.71032500         -0.00004340          0.05434640          0.10005870          1.00000000          0.00000000          0.00000000          0.00000000
          0.32095500          0.00004340         -0.00021780          0.41389930          0.00000000          1.00000000          0.00000000          0.00000000
          0.13935700         -0.00002080          0.00094540          0.47845530          0.00000000          0.00000000          1.00000000          0.00000000
          0.05841000          0.00000520         -0.00023010          0.17147690          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1424.45060000          0.00006660          0.00000000          0.00000000          0.00000000
        431.06676000          0.00065370          0.00000000          0.00000000          0.00000000
        168.12864000          0.00390410          0.00000000          0.00000000          0.00000000
         74.86672400          0.01639190          0.00000000          0.00000000          0.00000000
         35.94585500          0.05062320          0.00000000          0.00000000          0.00000000
         18.09847400          0.12110210          0.00000000          0.00000000          0.00000000
          9.40578000          0.21681690          0.00000000          0.00000000          0.00000000
          4.92390400          0.28874520          0.00000000          0.00000000          0.00000000
          2.55649300          0.29477690          0.00000000          0.00000000          0.00000000
          1.30423300          0.21559980          1.00000000          0.00000000          0.00000000
          0.63711800          0.09175750          0.00000000          1.00000000          0.00000000
          0.27579500          0.01430220          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.11530000          1.00000000
  1  3  3  1  1
          0.19600000          1.00000000
  1  3  3  1  1
          0.38590000          1.00000000
  1  3  3  1  1
          0.75990000          1.00000000
  1  4  4  1  1
          0.37000000          1.00000000
  1  4  4  1  1
          0.80920000          1.00000000
  1  5  5  1  1
          0.67730000          1.00000000
  1  0  0  1  1
          0.02941800          1.00000000
  1  1  1  1  1
          0.02204300          1.00000000
  1  2  2  1  1
          0.04880000          1.00000000
  1  3  3  1  1
          0.08990000          1.00000000
  1  4  4  1  1
          0.16550000          1.00000000
  1  5  5  1  1
          0.36680000          1.00000000
# SELENIUM
Se aug-cc-pV5Z
 16
  1  0  0 26  8
  154432250.00000000          0.00000019         -0.00000006          0.00000002         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   23129212.00000000          0.00000151         -0.00000047          0.00000019         -0.00000005          0.00000000          0.00000000          0.00000000          0.00000000
    5261792.90000000          0.00000796         -0.00000249          0.00000098         -0.00000029          0.00000000          0.00000000          0.00000000          0.00000000
    1488816.70000000          0.00003375         -0.00001056          0.00000415         -0.00000121          0.00000000          0.00000000          0.00000000          0.00000000
     484656.56000000          0.00012372         -0.00003873          0.00001524         -0.00000446          0.00000000          0.00000000          0.00000000          0.00000000
     174270.63000000          0.00040839         -0.00012786          0.00005031         -0.00001471          0.00000000          0.00000000          0.00000000          0.00000000
      67529.09000000          0.00124310         -0.00038980          0.00015346         -0.00004487          0.00000000          0.00000000          0.00000000          0.00000000
      27750.83700000          0.00353890         -0.00111230          0.00043780         -0.00012799          0.00000000          0.00000000          0.00000000          0.00000000
      11964.21600000          0.00948220         -0.00300070          0.00118270         -0.00034570          0.00000000          0.00000000          0.00000000          0.00000000
       5370.71480000          0.02389010         -0.00765630          0.00302080         -0.00088340          0.00000000          0.00000000          0.00000000          0.00000000
       2497.31940000          0.05587570         -0.01842210          0.00729920         -0.00213630          0.00000000          0.00000000          0.00000000          0.00000000
       1198.76790000          0.11791040         -0.04101840          0.01635280         -0.00478920          0.00000000          0.00000000          0.00000000          0.00000000
        592.58026000          0.21279620         -0.08230260          0.03329620         -0.00977580          0.00000000          0.00000000          0.00000000          0.00000000
        300.97708000          0.29893040         -0.13988400          0.05801390         -0.01708770          0.00000000          0.00000000          0.00000000          0.00000000
        156.46024000          0.27656510         -0.17703370          0.07702330         -0.02286560          0.00000000          0.00000000          0.00000000          0.00000000
         82.47608600          0.12929410         -0.08877610          0.04110650         -0.01230280          0.00000000          0.00000000          0.00000000          0.00000000
         42.27088700          0.01858750          0.22515370         -0.12257820          0.03752540          0.00000000          0.00000000          0.00000000          0.00000000
         22.63022000          0.00007730          0.52071710         -0.38533970          0.12443420          0.00000000          0.00000000          0.00000000          0.00000000
         12.12237400          0.00034270          0.36450930         -0.36750730          0.12311950          0.00000000          0.00000000          0.00000000          0.00000000
          6.24917000         -0.00017530          0.07361690          0.15743400         -0.06243300          0.00000000          0.00000000          0.00000000          0.00000000
          3.24267800          0.00003570          0.00235400          0.64408720         -0.28948340          0.00000000          0.00000000          0.00000000          0.00000000
          1.66636200         -0.00004065          0.00169470          0.44822090         -0.37443990          0.00000000          0.00000000          0.00000000          0.00000000
          0.78726400          0.00001819         -0.00039450          0.05999890         -0.00953280          1.00000000          0.00000000          0.00000000          0.00000000
          0.40297200         -0.00000883          0.00018307         -0.00219790          0.52692250          0.00000000          1.00000000          0.00000000          0.00000000
          0.18709600          0.00000375         -0.00008751          0.00131780          0.55925390          0.00000000          0.00000000          1.00000000          0.00000000
          0.08470600         -0.00000078          0.00001559         -0.00008922          0.14330280          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      36511.33700000          0.00003200         -0.00001270          0.00000310          0.00000000          0.00000000          0.00000000          0.00000000
       8640.55100000          0.00028540         -0.00011300          0.00002730          0.00000000          0.00000000          0.00000000          0.00000000
       2805.69110000          0.00165670         -0.00065820          0.00015930          0.00000000          0.00000000          0.00000000          0.00000000
       1073.49610000          0.00739550         -0.00295280          0.00071360          0.00000000          0.00000000          0.00000000          0.00000000
        455.77475000          0.02675430         -0.01082890          0.00262600          0.00000000          0.00000000          0.00000000          0.00000000
        208.09432000          0.07909890         -0.03281240          0.00796670          0.00000000          0.00000000          0.00000000          0.00000000
        100.23111000          0.18379670         -0.07950700          0.01944400          0.00000000          0.00000000          0.00000000          0.00000000
         50.07352200          0.31380410         -0.14302740          0.03513280          0.00000000          0.00000000          0.00000000          0.00000000
         25.70026200          0.34436500         -0.16277870          0.04040280          0.00000000          0.00000000          0.00000000          0.00000000
         13.34679200          0.18985910         -0.00429830         -0.00339690          0.00000000          0.00000000          0.00000000          0.00000000
          6.78705100          0.03791930          0.30918290         -0.09209990          0.00000000          0.00000000          0.00000000          0.00000000
          3.39165400          0.00217810          0.47760130         -0.15350900          0.00000000          0.00000000          0.00000000          0.00000000
          1.67032700          0.00065900          0.29285260         -0.10587050          0.00000000          0.00000000          0.00000000          0.00000000
          0.75259900         -0.00005240          0.04664190          0.15280370          1.00000000          0.00000000          0.00000000          0.00000000
          0.34681300          0.00003570         -0.00072780          0.43738130          0.00000000          1.00000000          0.00000000          0.00000000
          0.15185500         -0.00002220          0.00126660          0.43993060          0.00000000          0.00000000          1.00000000          0.00000000
          0.06385600          0.00000370         -0.00015320          0.14758170          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1635.06630000          0.00005910          0.00000000          0.00000000          0.00000000
        494.67266000          0.00058400          0.00000000          0.00000000          0.00000000
        192.84388000          0.00352560          0.00000000          0.00000000          0.00000000
         85.78219500          0.01511270          0.00000000          0.00000000          0.00000000
         41.14996600          0.04784460          0.00000000          0.00000000          0.00000000
         20.67817000          0.11743450          0.00000000          0.00000000          0.00000000
         10.72638600          0.21590740          0.00000000          0.00000000          0.00000000
          5.61245400          0.29292160          0.00000000          0.00000000          0.00000000
          2.92037600          0.30008640          0.00000000          0.00000000          0.00000000
          1.49818400          0.21367190          1.00000000          0.00000000          0.00000000
          0.73599900          0.08498330          0.00000000          1.00000000          0.00000000
          0.31600400          0.01180120          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.13310000          1.00000000
  1  3  3  1  1
          0.21000000          1.00000000
  1  3  3  1  1
          0.42110000          1.00000000
  1  3  3  1  1
          0.84420000          1.00000000
  1  4  4  1  1
          0.38500000          1.00000000
  1  4  4  1  1
          0.86590000          1.00000000
  1  5  5  1  1
          0.72350000          1.00000000
  1  0  0  1  1
          0.03393500          1.00000000
  1  1  1  1  1
          0.02497500          1.00000000
  1  2  2  1  1
          0.05480000          1.00000000
  1  3  3  1  1
          0.09920000          1.00000000
  1  4  4  1  1
          0.18300000          1.00000000
  1  5  5  1  1
          0.40200000          1.00000000
# BROMINE
Br aug-cc-pV5Z
 16
  1  0  0 26  8
  165735150.00000000          0.00000019         -0.00000006          0.00000002         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   24774379.00000000          0.00000149         -0.00000047          0.00000019         -0.00000006          0.00000000          0.00000000          0.00000000          0.00000000
    5628202.00000000          0.00000788         -0.00000247          0.00000098         -0.00000030          0.00000000          0.00000000          0.00000000          0.00000000
    1591899.70000000          0.00003339         -0.00001048          0.00000416         -0.00000128          0.00000000          0.00000000          0.00000000          0.00000000
     518263.80000000          0.00012231         -0.00003840          0.00001526         -0.00000468          0.00000000          0.00000000          0.00000000          0.00000000
     186490.92000000          0.00040321         -0.00012660          0.00005031         -0.00001542          0.00000000          0.00000000          0.00000000          0.00000000
      72332.49300000          0.00122564         -0.00038545          0.00015325         -0.00004697          0.00000000          0.00000000          0.00000000          0.00000000
      29761.13500000          0.00348235         -0.00109761          0.00043637         -0.00013372          0.00000000          0.00000000          0.00000000          0.00000000
      12851.71200000          0.00930856         -0.00295379          0.00117580         -0.00036049          0.00000000          0.00000000          0.00000000          0.00000000
       5780.94300000          0.02338830         -0.00751460          0.00299460         -0.00091798          0.00000000          0.00000000          0.00000000          0.00000000
       2695.00980000          0.05455300         -0.01802300          0.00721190         -0.00221290          0.00000000          0.00000000          0.00000000          0.00000000
       1297.66040000          0.11494790         -0.04002550          0.01611510         -0.00494730          0.00000000          0.00000000          0.00000000          0.00000000
        643.63493000          0.20792250         -0.08029190          0.03279430         -0.01009510          0.00000000          0.00000000          0.00000000          0.00000000
        327.95194000          0.29515960         -0.13721660          0.05743090         -0.01773240          0.00000000          0.00000000          0.00000000          0.00000000
        170.92262000          0.27987660         -0.17694390          0.07761870         -0.02416530          0.00000000          0.00000000          0.00000000          0.00000000
         90.25014100          0.13697520         -0.09770330          0.04564640         -0.01431800          0.00000000          0.00000000          0.00000000          0.00000000
         46.29246700          0.02121540          0.20676330         -0.11311710          0.03628120          0.00000000          0.00000000          0.00000000          0.00000000
         24.84866100         -0.00002540          0.51484190         -0.37955960          0.12865520          0.00000000          0.00000000          0.00000000          0.00000000
         13.34713700          0.00045700          0.37992060         -0.38514940          0.13568880          0.00000000          0.00000000          0.00000000          0.00000000
          6.94825800         -0.00023480          0.08301280          0.12368510         -0.05167640          0.00000000          0.00000000          0.00000000          0.00000000
          3.62507500          0.00006858          0.00321570          0.64061380         -0.30307240          0.00000000          0.00000000          0.00000000          0.00000000
          1.88215300         -0.00006116          0.00171290          0.47074360         -0.40738380          0.00000000          0.00000000          0.00000000          0.00000000
          0.91082200          0.00002905         -0.00038970          0.06907320         -0.00903930          1.00000000          0.00000000          0.00000000          0.00000000
          0.46395700         -0.00001366          0.00015530         -0.00130600          0.54552490          0.00000000          1.00000000          0.00000000          0.00000000
          0.21693300          0.00000573         -0.00008575          0.00141480          0.55826500          0.00000000          0.00000000          1.00000000          0.00000000
          0.09840600         -0.00000120          0.00001312         -0.00005245          0.13789010          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      39391.53000000          0.00003120         -0.00001250          0.00000320          0.00000000          0.00000000          0.00000000          0.00000000
       9325.22250000          0.00027800         -0.00011160          0.00002880          0.00000000          0.00000000          0.00000000          0.00000000
       3028.99430000          0.00161380         -0.00064990          0.00016840          0.00000000          0.00000000          0.00000000          0.00000000
       1159.51450000          0.00720490         -0.00291590          0.00075430          0.00000000          0.00000000          0.00000000          0.00000000
        492.68131000          0.02608730         -0.01070090          0.00278010          0.00000000          0.00000000          0.00000000          0.00000000
        225.17451000          0.07729710         -0.03249510          0.00844620          0.00000000          0.00000000          0.00000000          0.00000000
        108.59326000          0.18047750         -0.07911230          0.02073760          0.00000000          0.00000000          0.00000000          0.00000000
         54.33607900          0.31061260         -0.14352520          0.03775420          0.00000000          0.00000000          0.00000000          0.00000000
         27.93665000          0.34542970         -0.16582480          0.04420620          0.00000000          0.00000000          0.00000000          0.00000000
         14.53962600          0.19485150         -0.01065910         -0.00217750          0.00000000          0.00000000          0.00000000          0.00000000
          7.42130700          0.04038600          0.30506620         -0.09795300          0.00000000          0.00000000          0.00000000          0.00000000
          3.73038900          0.00230910          0.48135630         -0.16926560          0.00000000          0.00000000          0.00000000          0.00000000
          1.85412700          0.00067150          0.29427690         -0.11174900          0.00000000          0.00000000          0.00000000          0.00000000
          0.84533700         -0.00007170          0.04670190          0.17844220          1.00000000          0.00000000          0.00000000          0.00000000
          0.39215200          0.00003590         -0.00025850          0.44996580          0.00000000          1.00000000          0.00000000          0.00000000
          0.17276700         -0.00002790          0.00147790          0.42155970          0.00000000          0.00000000          1.00000000          0.00000000
          0.07290800          0.00000310         -0.00005130          0.13503800          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       1850.63540000          0.00005380          0.00000000          0.00000000          0.00000000
        557.07125000          0.00054020          0.00000000          0.00000000          0.00000000
        216.48687000          0.00330120          0.00000000          0.00000000          0.00000000
         96.13885000          0.01435510          0.00000000          0.00000000          0.00000000
         46.12638000          0.04611680          0.00000000          0.00000000          0.00000000
         23.20116400          0.11478730          0.00000000          0.00000000          0.00000000
         12.05592600          0.21453690          0.00000000          0.00000000          0.00000000
          6.32554500          0.29531310          0.00000000          0.00000000          0.00000000
          3.30492200          0.30409380          0.00000000          0.00000000          0.00000000
          1.70425300          0.21213150          1.00000000          0.00000000          0.00000000
          0.83994000          0.07978040          0.00000000          1.00000000          0.00000000
          0.35695300          0.01007360          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.15200000          1.00000000
  1  3  3  1  1
          0.25500000          1.00000000
  1  3  3  1  1
          0.49550000          1.00000000
  1  3  3  1  1
          0.96270000          1.00000000
  1  4  4  1  1
          0.43900000          1.00000000
  1  4  4  1  1
          0.97680000          1.00000000
  1  5  5  1  1
          0.81930000          1.00000000
  1  0  0  1  1
          0.03910600          1.00000000
  1  1  1  1  1
          0.02905200          1.00000000
  1  2  2  1  1
          0.07810000          1.00000000
  1  3  3  1  1
          0.13880000          1.00000000
  1  4  4  1  1
          0.21900000          1.00000000
  1  5  5  1  1
          0.49100000          1.00000000
# KRYPTON
Kr aug-cc-pV5Z
 16
  1  0  0 26  8
  182822090.00000000          0.00000018         -0.00000057          0.00000002         -0.00000001          0.00000000          0.00000000          0.00000000          0.00000000
   27356156.00000000          0.00000142         -0.00000045          0.00000018         -0.00000006          0.00000000          0.00000000          0.00000000          0.00000000
    6221170.40000000          0.00000746         -0.00000235          0.00000094         -0.00000030          0.00000000          0.00000000          0.00000000          0.00000000
    1760277.90000000          0.00003159         -0.00000994          0.00000399         -0.00000127          0.00000000          0.00000000          0.00000000          0.00000000
     573193.82000000          0.00011575         -0.00003640          0.00001462         -0.00000466          0.00000000          0.00000000          0.00000000          0.00000000
     206258.45000000          0.00038150         -0.00012010          0.00004819         -0.00001535          0.00000000          0.00000000          0.00000000          0.00000000
      80026.66900000          0.00115900         -0.00036540          0.00014670         -0.00004674          0.00000000          0.00000000          0.00000000          0.00000000
      32939.08400000          0.00329340         -0.00104070          0.00041770         -0.00013302          0.00000000          0.00000000          0.00000000          0.00000000
      14222.63300000          0.00881610         -0.00280380          0.00112670         -0.00035906          0.00000000          0.00000000          0.00000000          0.00000000
       6393.07070000          0.02221800         -0.00715090          0.00287690         -0.00091650          0.00000000          0.00000000          0.00000000          0.00000000
       2976.45380000          0.05208810         -0.01722040          0.00695490         -0.00221840          0.00000000          0.00000000          0.00000000          0.00000000
       1430.52540000          0.11063560         -0.03848000          0.01563650         -0.00498830          0.00000000          0.00000000          0.00000000          0.00000000
        707.92621000          0.20253260         -0.07786280          0.03208010         -0.01026610          0.00000000          0.00000000          0.00000000          0.00000000
        359.84847000          0.29263500         -0.13474230          0.05686890         -0.01824450          0.00000000          0.00000000          0.00000000          0.00000000
        187.14965000          0.28512240         -0.17761480          0.07848450         -0.02541100          0.00000000          0.00000000          0.00000000          0.00000000
         98.63452300          0.14550640         -0.10684130          0.05033980         -0.01639310          0.00000000          0.00000000          0.00000000          0.00000000
         50.54786900          0.02399390          0.18961320         -0.10427420          0.03469770          0.00000000          0.00000000          0.00000000          0.00000000
         27.16700400         -0.00009490          0.50918710         -0.37437610          0.13212830          0.00000000          0.00000000          0.00000000          0.00000000
         14.61509800          0.00055780          0.39398590         -0.40111310          0.14709250          0.00000000          0.00000000          0.00000000          0.00000000
          7.65135200         -0.00028700          0.09190320          0.09683880         -0.04182160          0.00000000          0.00000000          0.00000000          0.00000000
          3.99726300          0.00009660          0.00391950          0.64287760         -0.31952400          0.00000000          0.00000000          0.00000000          0.00000000
          2.08585300         -0.00007840          0.00174960          0.48606000         -0.43632860          0.00000000          0.00000000          0.00000000          0.00000000
          1.01479700          0.00003877         -0.00042580          0.07334560          0.00429110          1.00000000          0.00000000          0.00000000          0.00000000
          0.51978800         -0.00001822          0.00015290         -0.00100770          0.56455580          0.00000000          1.00000000          0.00000000          0.00000000
          0.24510300          0.00000763         -0.00009381          0.00160870          0.55028450          0.00000000          0.00000000          1.00000000          0.00000000
          0.11189600         -0.00000159          0.00001326         -0.00004393          0.12977100          0.00000000          0.00000000          0.00000000          1.00000000
  1  1  1 17  7
      42993.05600000          0.00002970         -0.00001210          0.00000330          0.00000000          0.00000000          0.00000000          0.00000000
      10173.72300000          0.00026510         -0.00010780          0.00002930          0.00000000          0.00000000          0.00000000          0.00000000
       3303.10570000          0.00154160         -0.00062900          0.00017130          0.00000000          0.00000000          0.00000000          0.00000000
       1263.54000000          0.00690650         -0.00283230          0.00076950          0.00000000          0.00000000          0.00000000          0.00000000
        536.36546000          0.02513970         -0.01044620          0.00285140          0.00000000          0.00000000          0.00000000          0.00000000
        244.87617000          0.07501240         -0.03194000          0.00872040          0.00000000          0.00000000          0.00000000          0.00000000
        117.99117000          0.17674330         -0.07845990          0.02161810          0.00000000          0.00000000          0.00000000          0.00000000
         59.02124800          0.30751350         -0.14397190          0.03980240          0.00000000          0.00000000          0.00000000          0.00000000
         30.35606700          0.34706440         -0.16917030          0.04747750          0.00000000          0.00000000          0.00000000          0.00000000
         15.81997700          0.20028020         -0.01759660         -0.00047730          0.00000000          0.00000000          0.00000000          0.00000000
          8.10458000          0.04305080          0.30026490         -0.10218910          0.00000000          0.00000000          0.00000000          0.00000000
          4.09796400          0.00247720          0.48476610         -0.18236110          0.00000000          0.00000000          0.00000000          0.00000000
          2.05606100          0.00067890          0.29672480         -0.11733630          0.00000000          0.00000000          0.00000000          0.00000000
          0.95214500         -0.00008210          0.04745330          0.19542440          1.00000000          0.00000000          0.00000000          0.00000000
          0.44477400          0.00004690         -0.00047280          0.45901760          0.00000000          1.00000000          0.00000000          0.00000000
          0.19749600         -0.00002210          0.00092530          0.40961740          0.00000000          0.00000000          1.00000000          0.00000000
          0.08382300          0.00000580         -0.00018470          0.12597150          0.00000000          0.00000000          0.00000000          1.00000000
  1  2  2 12  4
       2067.43600000          0.00004960          0.00000000          0.00000000          0.00000000
        625.69371000          0.00049440          0.00000000          0.00000000          0.00000000
        243.94679000          0.00302650          0.00000000          0.00000000          0.00000000
        108.42373000          0.01334610          0.00000000          0.00000000          0.00000000
         52.00521600          0.04378690          0.00000000          0.00000000          0.00000000
         26.11540500          0.11143880          0.00000000          0.00000000          0.00000000
         13.54674800          0.21303410          0.00000000          0.00000000          0.00000000
          7.10581000          0.29792410          0.00000000          0.00000000          0.00000000
          3.72155400          0.30796600          0.00000000          0.00000000          0.00000000
          1.92912000          0.21107750          1.00000000          0.00000000          0.00000000
          0.95582600          0.07632610          0.00000000          1.00000000          0.00000000
          0.40519700          0.00917330          0.00000000          0.00000000          1.00000000
  1  2  2  1  1
          0.17410000          1.00000000
  1  3  3  1  1
          0.31500000          1.00000000
  1  3  3  1  1
          0.58700000          1.00000000
  1  3  3  1  1
          1.09400000          1.00000000
  1  4  4  1  1
          0.50100000          1.00000000
  1  4  4  1  1
          1.10400000          1.00000000
  1  5  5  1  1
          0.93030000          1.00000000
  1  0  0  1  1
          0.04427700          1.00000000
  1  1  1  1  1
          0.03312900          1.00000000
  1  2  2  1  1
          0.10140000          1.00000000
  1  3  3  1  1
          0.17840000          1.00000000
  1  4  4  1  1
          0.25500000          1.00000000
  1  5  5  1  1
          0.58000000          1.00000000
# BASIS="IGLO-II"
#W. Kutzelnigg, U. Fleischer, M. Schindler, The IGLO-Method: Ab Initio
#Calculation and Interpretation of NMR Chemical Shifts and Magnetic
#Susceptibilities, Springer-Verlag, Heidelberg, 1990, vol. 23.
#
# HYDROGEN    (5s,1p) -> [3s,1p]
H  IGLO-II
  4
  1  0  0  3  1
         33.64440000          0.00612000
          5.05796000          0.04575000
          1.14680000          0.20572000
  1  0  0  1  1
          0.32114400          1.00000000
  1  0  0  1  1
          0.10130900          1.00000000
  1  1  1  1  1
          0.65000000          1.00000000
# BORON       (9s,5p,1d) -> [5s,4p,1d]
B  IGLO-II
 10
  1  0  0  5  1
       2796.60350000          0.00128223
        420.86799000          0.00976641
         96.91586600          0.04745255
         28.10305800          0.16028625
          9.37843840          0.36191858
  1  0  0  1  1
          3.42809720          1.00000000
  1  0  0  1  1
          1.33539380          1.00000000
  1  0  0  1  1
          0.32384228          1.00000000
  1  0  0  1  1
          0.10202139          1.00000000
  1  1  1  2  1
         11.29072000          0.01444998
          2.42571240          0.08829204
  1  1  1  1  1
          0.68564974          1.00000000
  1  1  1  1  1
          0.21569117          1.00000000
  1  1  1  1  1
          0.07010236          1.00000000
  1  2  2  1  1
          0.70000000          1.00000000
# CARBON      (9s,5p,1d) -> [5s,4p,1d]
C  IGLO-II
 10
  1  0  0  5  1
       4240.30980000          0.00121522
        637.77827000          0.00927316
        146.74534000          0.04527924
         42.53142800          0.15492334
         14.18480400          0.35808349
  1  0  0  1  1
          5.17569430          1.00000000
  1  0  0  1  1
          2.00725310          1.00000000
  1  0  0  1  1
          0.49677422          1.00000000
  1  0  0  1  1
          0.15348718          1.00000000
  1  1  1  2  1
         18.09914400          0.01476051
          3.97691450          0.09164935
  1  1  1  1  1
          1.14507680          1.00000000
  1  1  1  1  1
          0.36188831          1.00000000
  1  1  1  1  1
          0.11460548          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# NITROGEN    (9s,5p,1d) -> [5s,4p,1d]
N  IGLO-II
 10
  1  0  0  5  1
       6024.27360000          0.00116038
        906.59577000          0.00885007
        208.44780000          0.04350415
         60.10368300          0.15154374
         19.97334800          0.35487068
  1  0  0  1  1
          7.33419850          1.00000000
  1  0  0  1  1
          2.89381940          1.00000000
  1  0  0  1  1
          0.70806350          1.00000000
  1  0  0  1  1
          0.21581223          1.00000000
  1  1  1  2  1
         26.36260900          0.01490106
          5.87773430          0.09333825
  1  1  1  1  1
          1.71678920          1.00000000
  1  1  1  1  1
          0.54594357          1.00000000
  1  1  1  1  1
          0.16994634          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# OXYGEN      (9s,5p,1d) -> [5s,4p,1d]
O  IGLO-II
 10
  1  0  0  5  1
       8046.15900000          0.00113460
       1211.98490000          0.00863654
        279.52491000          0.04229787
         80.93299600          0.14760311
         26.93427000          0.35147639
  1  0  0  1  1
          9.83933200          1.00000000
  1  0  0  1  1
          3.83403740          1.00000000
  1  0  0  1  1
          0.95681143          1.00000000
  1  0  0  1  1
          0.28899604          1.00000000
  1  1  1  2  1
         34.90661400          0.01561769
          7.84656390          0.09828103
  1  1  1  1  1
          2.30498550          1.00000000
  1  1  1  1  1
          0.72205670          1.00000000
  1  1  1  1  1
          0.21525878          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# FLUORINE    (9s,5p,1d) -> [5s,4p,1d]
F  IGLO-II
 10
  1  0  0  5  1
      10255.86300000          0.00112926
       1545.55750000          0.00858680
        357.06977000          0.04195714
        103.63143000          0.14649137
         34.50261600          0.35191132
  1  0  0  1  1
         12.54609500          1.00000000
  1  0  0  1  1
          4.83183280          1.00000000
  1  0  0  1  1
          1.23312350          1.00000000
  1  0  0  1  1
          0.36996157          1.00000000
  1  1  1  2  1
         44.60800700          0.01624853
         10.09667300          0.10219615
  1  1  1  1  1
          2.98488130          1.00000000
  1  1  1  1  1
          0.93222839          1.00000000
  1  1  1  1  1
          0.27221117          1.00000000
  1  2  2  1  1
          1.00000000          1.00000000
# ALUMINUM    (11s,6p,2d) -> [7s,6p,2d]
AL IGLO-II
 15
  1  0  0  5  1
      23491.08200000          0.00101595
       3547.63230000          0.00768970
        823.47199000          0.03763183
        237.67938000          0.13604661
         78.60205900          0.33655292
  1  0  0  1  1
         29.04990600          1.00000000
  1  0  0  1  1
         11.62381200          1.00000000
  1  0  0  1  1
          3.46534310          1.00000000
  1  0  0  1  1
          1.23314290          1.00000000
  1  0  0  1  1
          0.20181005          1.00000000
  1  0  0  1  1
          0.07804797          1.00000000
  1  1  1  2  1
        141.51036000          0.01099731
         33.21762900          0.07398327
  1  1  1  1  1
         10.39301400          1.00000000
  1  1  1  1  1
          3.59258390          1.00000000
  1  1  1  1  1
          1.24210200          1.00000000
  1  1  1  1  1
          0.30402357          1.00000000
  1  1  1  1  1
          0.07628914          1.00000000
  1  2  2  1  1
          0.30000000          1.00000000
  1  2  2  1  1
          1.20000000          1.00000000
# SILICON     (11s,6p,2d) -> [7s,6p,2d]
SI IGLO-II
 15
  1  0  0  5  1
      26737.38900000          0.00103912
       4076.37860000          0.00773771
        953.29315000          0.03775636
        274.58441000          0.13727615
         90.68198700          0.33903718
  1  0  0  1  1
         33.52905700          1.00000000
  1  0  0  1  1
         13.45762900          1.00000000
  1  0  0  1  1
          4.05069160          1.00000000
  1  0  0  1  1
          1.48418390          1.00000000
  1  0  0  1  1
          0.27044323          1.00000000
  1  0  0  1  1
          0.09932161          1.00000000
  1  1  1  2  1
        163.73270000          0.01165726
         38.35208100          0.07880208
  1  1  1  1  1
         12.02111400          1.43833500
  1  1  1  1  1
          4.18457330          1.00000000
  1  1  1  1  1
          1.48271700          1.00000000
  1  1  1  1  1
          0.33498569          1.00000000
  1  1  1  1  1
          0.09699384          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# PHOSPHORUS  (11s,6p,2d) -> [7s,6p,2d]
P  IGLO-II
 15
  1  0  0  5  1
      30632.37800000          0.00104101
       4684.25210000          0.00774569
       1093.59030000          0.03786800
        315.28033000          0.13740569
        104.11763000          0.34053492
  1  0  0  1  1
         38.41572400          0.13070600
  1  0  0  1  1
         15.44653100          1.00000000
  1  0  0  1  1
          4.65597040          1.00000000
  1  0  0  1  1
          1.75887740          1.00000000
  1  0  0  1  1
          0.34094694          1.00000000
  1  0  0  1  1
          0.12377993          1.00000000
  1  1  1  2  1
        187.73871000          0.01225194
         43.63355000          0.08424910
  1  1  1  1  1
         13.60316900          1.00000000
  1  1  1  1  1
          4.76604610          1.00000000
  1  1  1  1  1
          1.74261850          1.00000000
  1  1  1  1  1
          0.41920305          1.00000000
  1  1  1  1  1
          0.12451394          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# SULFUR      (11s,6p,2d) -> [7s,6p,2d]
S  IGLO-II
 15
  1  0  0  5  1
      35713.98400000          0.00101591
       5396.62770000          0.00768960
       1249.70930000          0.03785909
        359.93426000          0.13697350
        119.17126000          0.33927126
  1  0  0  1  1
         43.98355800          1.00000000
  1  0  0  1  1
         17.62667400          1.00000000
  1  0  0  1  1
          5.42009030          1.00000000
  1  0  0  1  1
          2.07387300          1.00000000
  1  0  0  1  1
          0.42642466          1.00000000
  1  0  0  1  1
          0.15187254          1.00000000
  1  1  1  2  1
        212.86586000          0.01277611
         49.60019500          0.08768841
  1  1  1  1  1
         15.51553800          1.00000000
  1  1  1  1  1
          5.47557110          1.00000000
  1  1  1  1  1
          2.04415270          1.00000000
  1  1  1  1  1
          0.52179721          1.00000000
  1  1  1  1  1
          0.15064449          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          1.60000000          1.00000000
# CHLORINE    (11s,6p,2d) -> [7s,6p,2d]
CL IGLO-II
 15
  1  0  0  5  1
      40847.56400000          0.00099932
       6178.59730000          0.00758054
       1424.64280000          0.03758571
        409.20969000          0.13635939
        135.47646000          0.33796115
  1  0  0  1  1
         50.13194300          1.00000000
  1  0  0  1  1
         20.20993500          1.00000000
  1  0  0  1  1
          6.28271010          1.00000000
  1  0  0  1  1
          2.45955460          1.00000000
  1  0  0  1  1
          0.52706222          1.00000000
  1  0  0  1  1
          0.18840804          1.00000000
  1  1  1  2  1
        240.76687000          0.01310385
         56.56240600          0.08895447
  1  1  1  1  1
         17.84577800          1.00000000
  1  1  1  1  1
          6.34988070          1.00000000
  1  1  1  1  1
          2.40307540          1.00000000
  1  1  1  1  1
          0.64102163          1.00000000
  1  1  1  1  1
          0.18375019          1.00000000
  1  2  2  1  1
          0.40000000          1.00000000
  1  2  2  1  1
          1.60000000          1.00000000
# BASIS="IGLO-III"
#W. Kutzelnigg, U. Fleischer, M. Schindler,Al - Cl:  The IGLO-Method: Ab Initio
#Calculation and Interpretation of NMR Chemical Shifts and Magnetic
#Susceptibilities, Springer-Verlag, Heidelberg, 1990, vol. 23.
#
# HYDROGEN    (6s,2p) -> [4s,2p]
H  IGLO-III
  6
  1  0  0  3  1
         68.16000000          0.00255000
         10.24650000          0.01938000
          2.34648000          0.09280000
  1  0  0  1  1
          0.67332000          1.00000000
  1  0  0  1  1
          0.22466000          1.00000000
  1  0  0  1  1
          0.08221700          1.00000000
  1  1  1  1  1
          0.33000000          1.00000000
  1  1  1  1  1
          1.30000000          1.00000000
# BORON       (11s,7p,2d) -> [7s,6p,2d]
B  IGLO-III
 15
  1  0  0  5  1
      10624.88800000          0.00024298
       1587.95630000          0.00189462
        357.95831000          0.01002374
         99.26325900          0.04174382
         31.47135600          0.13581952
  1  0  0  1  1
         10.92100300          1.00000000
  1  0  0  1  1
          4.07019350          1.00000000
  1  0  0  1  1
          1.61755990          1.00000000
  1  0  0  1  1
          0.42720825          1.00000000
  1  0  0  1  1
          0.16635220          1.00000000
  1  0  0  1  1
          0.06656824          1.00000000
  1  1  1  2  1
         24.22602800          0.00441052
          5.67794760          0.02756931
  1  1  1  1  1
          1.75378250          1.00000000
  1  1  1  1  1
          0.64115199          1.00000000
  1  1  1  1  1
          0.25505904          1.00000000
  1  1  1  1  1
          0.10423302          1.00000000
  1  1  1  1  1
          0.04275910          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# CARBON      (11s,7p,2d) -> [7s,6p,2d]
C  IGLO-III
 15
  1  0  0  5  1
      16371.07400000          0.00022642
       2426.99250000          0.00178447
        544.54418000          0.00949016
        150.80487000          0.03966052
         47.70814300          0.13134026
  1  0  0  1  1
         16.45724100          1.00000000
  1  0  0  1  1
          6.08455780          1.00000000
  1  0  0  1  1
          2.38246310          1.00000000
  1  0  0  1  1
          0.66198660          1.00000000
  1  0  0  1  1
          0.24698997          1.00000000
  1  0  0  1  1
          0.09498730          1.00000000
  1  1  1  2  1
         40.79042300          0.00409698
          9.50346330          0.02758477
  1  1  1  1  1
          2.94083570          1.00000000
  1  1  1  1  1
          1.07511150          1.00000000
  1  1  1  1  1
          0.42670240          1.00000000
  1  1  1  1  1
          0.17481926          1.00000000
  1  1  1  1  1
          0.07113054          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# NITROGEN    (11s,7p,2d) -> [7s,6p,2d]
N  IGLO-III
 15
  1  0  0  5  1
      23274.85700000          0.00021521
       3468.18300000          0.00169214
        777.98843000          0.00899407
        215.71976000          0.03773039
         68.07803100          0.12667110
  1  0  0  1  1
         23.42439700          1.00000000
  1  0  0  1  1
          8.66937660          1.00000000
  1  0  0  1  1
          3.42175330          1.00000000
  1  0  0  1  1
          0.93125652          1.00000000
  1  0  0  1  1
          0.34656886          1.00000000
  1  0  0  1  1
          0.13311530          1.00000000
  1  1  1  2  1
         60.31724000          0.00397658
         14.10081100          0.02764197
  1  1  1  1  1
          4.38771790          1.00000000
  1  1  1  1  1
          1.60827170          1.00000000
  1  1  1  1  1
          0.63885442          1.00000000
  1  1  1  1  1
          0.26035829          1.00000000
  1  1  1  1  1
          0.10396545          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# OXYGEN      (11s,7p,2d) -> [7s,6p,2d]
O  IGLO-III
 15
  1  0  0  5  1
      30664.50300000          0.00021414
       4573.20140000          0.00167798
       1029.55240000          0.00888147
        285.90474000          0.03728134
         90.36965300          0.12518867
  1  0  0  1  1
         31.21957800          1.00000000
  1  0  0  1  1
         11.60776600          1.00000000
  1  0  0  1  1
          4.59275950          1.00000000
  1  0  0  1  1
          1.27117160          1.00000000
  1  0  0  1  1
          0.47214017          1.00000000
  1  0  0  1  1
          0.17896534          1.00000000
  1  1  1  2  1
         78.70294300          0.00424160
         18.40926100          0.02986846
  1  1  1  1  1
          5.75308350          1.00000000
  1  1  1  1  1
          2.11071140          1.00000000
  1  1  1  1  1
          0.83712087          1.00000000
  1  1  1  1  1
          0.33907630          1.00000000
  1  1  1  1  1
          0.13226310          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# FLUORINE    (11s,7p,2d) -> [7s,6p,2d]
F  IGLO-III
 15
  1  0  0  5  1
      37736.00000000          0.00021825
       5867.07910000          0.00163322
       1332.46790000          0.00868178
        369.44060000          0.03654339
        116.84300000          0.12310963
  1  0  0  1  1
         40.34877000          1.00000000
  1  0  0  1  1
         14.96627000          1.00000000
  1  0  0  1  1
          5.87592950          1.00000000
  1  0  0  1  1
          1.65333520          1.00000000
  1  0  0  1  1
          0.61083583          1.00000000
  1  0  0  1  1
          0.23328922          1.00000000
  1  1  1  2  1
        102.26192000          0.00427323
         23.93838100          0.03053431
  1  1  1  1  1
          7.52059140          1.00000000
  1  1  1  1  1
          2.77245660          1.00000000
  1  1  1  1  1
          1.10005140          1.00000000
  1  1  1  1  1
          0.44677512          1.00000000
  1  1  1  1  1
          0.17187009          1.00000000
  1  2  2  1  1
          0.35000000          1.00000000
  1  2  2  1  1
          1.40000000          1.00000000
# ALUMINUM    (12s,8p,3d) -> [8s,7p,3d]
AL IGLO-III
 18
  1  0  0  5  1
      55112.70000000          0.00035194
       8204.66000000          0.00275036
       1863.56000000          0.01418546
        530.19500000          0.05585327
        174.89500000          0.16789086
  1  0  0  1  1
         64.00900000          1.00000000
  1  0  0  1  1
         25.32310000          1.00000000
  1  0  0  1  1
         10.56390000          1.00000000
  1  0  0  1  1
          3.21260000          1.00000000
  1  0  0  1  1
          1.15432000          1.00000000
  1  0  0  1  1
          0.17812800          1.00000000
  1  0  0  1  1
          0.06588500          1.00000000
  1  1  1  2  1
        352.54595000          0.00241249
         83.01561600          0.01910968
  1  1  1  1  1
         26.00394600          1.00000000
  1  1  1  1  1
          9.23208790          1.00000000
  1  1  1  1  1
          3.35497620          1.00000000
  1  1  1  1  1
          1.18829010          1.00000000
  1  1  1  1  1
          0.27615887          1.00000000
  1  1  1  1  1
          0.07277382          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
# SILICON     (12s,8p,3d) -> [8s,7p,3d]
SI IGLO-III
 18
  1  0  0  5  1
      69989.30000000          0.00031441
      10380.20000000          0.00249143
       2330.01000000          0.01303542
        657.46600000          0.05227004
        214.00400000          0.16151425
  1  0  0  1  1
         77.60640000          1.00000000
  1  0  0  1  1
         30.63950000          1.00000000
  1  0  0  1  1
         12.81560000          1.00000000
  1  0  0  1  1
          3.92714000          1.00000000
  1  0  0  1  1
          1.45221000          1.00000000
  1  0  0  1  1
          0.25764400          1.00000000
  1  0  0  1  1
          0.09440400          1.00000000
  1  1  1  2  1
        401.60490000          0.00260893
         95.35242600          0.02025886
  1  1  1  1  1
         30.33422000          1.43833500
  1  1  1  1  1
         10.94372700          1.00000000
  1  1  1  1  1
          4.04168220          1.00000000
  1  1  1  1  1
          1.46154790          1.00000000
  1  1  1  1  1
          0.33021241          1.00000000
  1  1  1  1  1
          0.09522172          1.00000000
  1  2  2  1  1
          0.15000000          1.00000000
  1  2  2  1  1
          0.60000000          1.00000000
  1  2  2  1  1
          2.40000000          1.00000000
# PHOSPHORUS  (12s,8p,3d) -> [8s,7p,3d]
P  IGLO-III
 18
  1  0  0  5  1
      77492.39800000          0.00032906
      11605.79400000          0.00255174
       2645.96280000          0.01313011
        753.97763000          0.05189689
        248.75403000          0.15794319
  1  0  0  1  1
         91.15662300          1.00000000
  1  0  0  1  1
         36.22561800          1.00000000
  1  0  0  1  1
         15.21115500          1.00000000
  1  0  0  1  1
          4.71394850          1.00000000
  1  0  0  1  1
          1.78254320          1.00000000
  1  0  0  1  1
          0.34271273          1.00000000
  1  0  0  1  1
          0.12471095          1.00000000
  1  1  1  2  1
        447.03882000          0.00282929
        108.29827000          0.02130874
  1  1  1  1  1
         34.76738800          1.00000000
  1  1  1  1  1
         12.58337900          1.00000000
  1  1  1  1  1
          4.69885490          1.00000000
  1  1  1  1  1
          1.75275990          1.00000000
  1  1  1  1  1
          0.42209549          1.00000000
  1  1  1  1  1
          0.12532092          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          2.50000000          1.00000000
# SULFUR      (12s,8p,3d) -> [8s,7p,3d]
S  IGLO-III
 18
  1  0  0  5  1
      94181.10000000          0.00030557
      13921.80000000          0.00240104
       3168.04000000          0.01235431
        901.84300000          0.04909915
        296.95400000          0.15099018
  1  0  0  1  1
        108.66900000          1.00000000
  1  0  0  1  1
         43.15790000          1.00000000
  1  0  0  1  1
         18.11680000          1.00000000
  1  0  0  1  1
          5.57096000          1.00000000
  1  0  0  1  1
          2.14287000          1.00000000
  1  0  0  1  1
          0.43438900          1.00000000
  1  0  0  1  1
          0.15709300          1.00000000
  1  1  1  2  1
        532.03127000          0.00273507
        126.63701000          0.02160476
  1  1  1  1  1
         39.75234800          1.00000000
  1  1  1  1  1
         14.14024300          1.00000000
  1  1  1  1  1
          5.26069100          1.00000000
  1  1  1  1  1
          2.00635500          1.00000000
  1  1  1  1  1
          0.51597093          1.00000000
  1  1  1  1  1
          0.14946546          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          2.50000000          1.00000000
# CHLORINE    (12s,8p,3d) -> [8s,7p,3d]
CL IGLO-III
 18
  1  0  0  5  1
     105818.82000000          0.00030548
      15872.00600000          0.00236515
       3619.65480000          0.01218928
       1030.80380000          0.04841340
        339.90788000          0.14895259
  1  0  0  1  1
        124.53810000          1.00000000
  1  0  0  1  1
         49.51350200          1.00000000
  1  0  0  1  1
         20.80560400          1.00000000
  1  0  0  1  1
          6.46482380          1.00000000
  1  0  0  1  1
          2.52545370          1.00000000
  1  0  0  1  1
          0.53783215          1.00000000
  1  0  0  1  1
          0.19349716          1.00000000
  1  1  1  2  1
        622.02736000          0.00267992
        145.49719000          0.02203724
  1  1  1  1  1
         45.00865900          1.00000000
  1  1  1  1  1
         15.90088900          1.00000000
  1  1  1  1  1
          5.92594370          1.00000000
  1  1  1  1  1
          2.29438220          1.00000000
  1  1  1  1  1
          0.62806550          1.00000000
  1  1  1  1  1
          0.18123318          1.00000000
  1  2  2  1  1
          0.25000000          1.00000000
  1  2  2  1  1
          0.80000000          1.00000000
  1  2  2  1  1
          2.50000000          1.00000000
# BASIS="Sadlej pVTZ"
#A. J. Sadlej, Collec. Czech. Chem. Commun.  53, 1995 (1988)
# A. J. Sadlej and M. Urban, J. Mol. Struct. (THEOCHEM) 234, 147 (1991)
# A. J. Sadlej, Theor. Chim. Acta 79, 123 (1992)
# A. J. Sadlej, Theor. Chim. Acta 81, 45 (1992)
# A. J. Sadlej, Theor. Chim. Acta 81, 339 (1992)
#
# HYDROGEN    (6S,4P) -> [3S,2P]
H  Sadlej-pVTZ
  5
  1  0  0  4  1
         33.86501400          0.00606800
          5.09478800          0.04531600
          1.15878600          0.20284600
          0.32584000          0.50370900
  1  0  0  1  1
          0.10274100          1.00000000
  1  0  0  1  1
          0.03240000          1.00000000
  1  1  1  2  1
          1.15880000          0.18844000
          0.32580000          0.88242000
  1  1  1  2  1
          0.10270000          0.11780000
          0.03240000          0.00420000
# LITHIUM     (10S,6P,4D) -> [5S,3P,2D]
LI Sadlej-pVTZ
 10
  1  0  0  5  1
       1359.44660000          0.00084400
        204.02647000          0.00648600
         46.54954100          0.03247700
         13.23259400          0.11742000
          4.28614800          0.29458000
  1  0  0  2  1
          1.49554200          0.44951500
          0.54223800          0.54223800
  1  0  0  1  1
          0.07396800          1.00000000
  1  0  0  1  1
          0.02809500          1.00000000
  1  0  0  1  1
          0.01067100          1.00000000
  1  1  1  4  1
          4.17000000          0.00511200
          1.17256000          0.02090700
          0.32927000          0.09167200
          0.09271000          0.44926000
  1  1  1  1  1
          0.02607000          1.00000000
  1  1  1  1  1
          0.00733100          1.00000000
  1  2  2  2  1
          0.32927000          0.15975700
          0.09271000          1.47548400
  1  2  2  2  1
          0.02607000          0.37057800
          0.00733100          0.01784700
# BERYLLIUM   (10S,6P,4D) -> [5S,3P,2D]
BE Sadlej-pVTZ
 10
  1  0  0  5  1
       2732.32810000          0.00074500
        410.31981000          0.00572200
         93.67264800          0.02888000
         26.58795700          0.10707600
          8.62956000          0.28010100
  1  0  0  2  1
          3.05626400          0.44544800
          1.13242400          0.28026200
  1  0  0  1  1
          0.18173200          1.00000000
  1  0  0  1  1
          0.05917000          1.00000000
  1  0  0  1  1
          0.01926500          1.00000000
  1  1  1  4  1
          7.64000000          0.00463000
          1.86360000          0.03296100
          0.45509000          0.12040400
          0.11107000          0.33952300
  1  1  1  1  1
          0.02710800          1.00000000
  1  1  1  1  1
          0.00661600          1.00000000
  1  2  2  2  1
          0.45509000          0.17848000
          0.11107000          1.01876000
  1  2  2  2  1
          0.02710800          0.42236400
          0.00661600          0.06003300
# CARBON      (10S,6P,4D) -> [5S,3P,2D]
C  Sadlej-pVTZ
 10
  1  0  0  5  1
       5240.63530000          0.00093700
        782.20480000          0.00722800
        178.35083000          0.03634400
         50.81594200          0.13060000
         16.82356200          0.31893100
  1  0  0  2  1
          6.17577600          0.43874200
          2.41804900          0.21497400
  1  0  0  1  1
          0.51190000          1.00000000
  1  0  0  1  1
          0.15659000          1.00000000
  1  0  0  1  1
          0.04790000          1.00000000
  1  1  1  4  1
         18.84180000          0.01388700
          4.15924000          0.08627900
          1.20671000          0.28874400
          0.38554000          0.49941100
  1  1  1  1  1
          0.12194000          1.00000000
  1  1  1  1  1
          0.03856800          1.00000000
  1  2  2  2  1
          1.20670000          0.26285000
          0.38550000          0.80430000
  1  2  2  2  1
          0.12190000          0.65350000
          0.03860000          0.86360000
# NITROGEN    (10S,6P,4D) -> [5S,3P,2D]
N  Sadlej-pVTZ
 10
  1  0  0  5  1
       8104.07160000          0.00080200
       1216.02150000          0.00617400
        277.23428000          0.03123300
         76.90402300          0.11519800
         25.87441900          0.29695100
  1  0  0  2  1
          9.34676700          0.44734900
          3.57979400          0.24500300
  1  0  0  1  1
          0.73961000          1.00000000
  1  0  0  1  1
          0.22261700          1.00000000
  1  0  0  1  1
          0.06700600          1.00000000
  1  1  1  4  1
         26.86898700          0.01447800
          5.99122700          0.09115600
          1.75084200          0.29742000
          0.56051100          0.49379600
  1  1  1  1  1
          0.17594800          1.00000000
  1  1  1  1  1
          0.05523100          1.00000000
  1  2  2  2  1
          1.75080000          0.22477000
          0.56050000          0.65956000
  1  2  2  2  1
          0.17959000          0.87136000
          0.05520000          0.70422000
# OXYGEN      (10S,6P,4D) -> [5S,3P,2D]
O  Sadlej-pVTZ
 10
  1  0  0  5  1
      10662.28500000          0.00079900
       1599.70970000          0.00615300
        364.72526000          0.03115700
        103.65179000          0.11559600
         33.90580500          0.30155200
  1  0  0  2  1
         12.28746900          0.44487000
          4.75680500          0.24317200
  1  0  0  1  1
          1.00427100          1.00000000
  1  0  0  1  1
          0.30068600          1.00000000
  1  0  0  1  1
          0.09003000          1.00000000
  1  1  1  4  1
         34.85646300          0.01564800
          7.84313100          0.09819700
          2.30624900          0.30776800
          0.72316400          0.49247000
  1  1  1  1  1
          0.21488200          1.00000000
  1  1  1  1  1
          0.06385000          1.00000000
  1  2  2  2  1
          2.30620000          0.20270000
          0.72320000          0.57910000
  1  2  2  2  1
          0.21490000          0.78545000
          0.06390000          0.53387000
# FLUORINE    (10S,6P,4D) -> [5S,3P,2D]
F  Sadlej-pVTZ
 10
  1  0  0  5  1
      13521.52300000          0.00080100
       2028.69160000          0.00616400
        462.37392000          0.03124400
        131.37366000          0.11608100
         42.97453100          0.30358900
  1  0  0  2  1
         15.57144000          0.44590400
          6.03223200          0.23911500
  1  0  0  1  1
          1.30721500          1.00000000
  1  0  0  1  1
          0.38886900          1.00000000
  1  0  0  1  1
          0.11568000          1.00000000
  1  1  1  4  1
         44.14730300          0.01650900
          9.99342600          0.10348100
          2.95324600          0.31548100
          0.91859700          0.48935300
  1  1  1  1  1
          0.26682400          1.00000000
  1  1  1  1  1
          0.07750000          1.00000000
  1  2  2  2  1
          2.95320000          0.18354000
          0.91860000          0.51058000
  1  2  2  2  1
          0.26680000          0.69925000
          0.07750000          0.42926000
# SODIUM      (14S,10P,4D) -> [7S,5P,2D]
NA Sadlej-pVTZ
 13
  1  0  0  8  2
      36166.40000000          0.00103200          0.00000000
       5372.58000000          0.00807100          0.00000000
       1213.21000000          0.04212800          0.00000000
        339.62000000          0.16978600          0.00000000
        109.55000000          0.51460900          0.00000000
         38.77700000          0.37983400          0.37476300
         14.57600000          0.00000000          0.57577100
          5.26990000          0.00000000          0.11392800
  1  0  0  1  1
          1.82780000          1.00000000
  1  0  0  1  1
          0.61990000          1.00000000
  1  0  0  1  1
          0.05720000          1.00000000
  1  0  0  1  1
          0.02400000          1.00000000
  1  0  0  1  1
          0.01010000          1.00000000
  1  1  1  6  1
        144.64500000          0.00545700
         33.90700000          0.03913800
         10.62900000          0.15192400
          3.82390000          0.33309800
          1.44430000          0.42228400
          0.55260000          0.28119700
  1  1  1  1  1
          0.18870000          1.00000000
  1  1  1  1  1
          0.04650000          1.00000000
  1  1  1  1  1
          0.01630000          1.00000000
  1  1  1  1  1
          0.00570000          1.00000000
  1  2  2  2  1
          1.44430000          0.35137900
          0.55260000          0.37827300
  1  2  2  2  1
          0.18870000          0.01118000
          0.04650000          0.27875100
# MAGNESIUM   (14S,10P,4D) -> [7S,5P,2D]
MG Sadlej-pVTZ
 13
  1  0  0  8  2
      43886.50000000          0.00091800          0.00000000
       6605.37000000          0.00704700          0.00000000
       1513.26000000          0.03594100          0.00000000
        432.31700000          0.14146100          0.00000000
        142.14900000          0.42676300          0.00000000
         51.39800000          0.49797600          0.25135500
         19.92000000          0.00000000          0.61867100
          8.02470000          0.00000000          0.18841600
  1  0  0  1  1
          2.50820000          1.00000000
  1  0  0  1  1
          0.87150000          1.00000000
  1  0  0  1  1
          0.10820000          1.00000000
  1  0  0  1  1
          0.04010000          1.00000000
  1  0  0  1  1
          0.01490000          1.00000000
  1  1  1  6  1
        193.85400000          0.00480200
         45.44200000          0.03551600
         14.18600000          0.14489300
          5.05750000          0.33817900
          1.88860000          0.44110400
          0.72270000          0.26084900
  1  1  1  1  1
          0.23640000          1.00000000
  1  1  1  1  1
          0.09340000          1.00000000
  1  1  1  1  1
          0.03480000          1.00000000
  1  1  1  1  1
          0.01300000          1.00000000
  1  2  2  2  1
          1.88860000          0.32097500
          0.72270000          0.30683900
  1  2  2  2  1
          0.23640000          0.02804400
          0.09340000          0.17855400
# SILICON     (14S,10P,4D) -> [7S,5P,2D]
SI Sadlej-pVTZ
 13
  1  0  0  8  2
      69379.23000000          0.00075700          0.00000000
      10354.94000000          0.00593200          0.00000000
       2333.88000000          0.03108800          0.00000000
        657.14000000          0.12496600          0.00000000
        214.30000000          0.38689600          0.00000000
         77.62900000          0.55489000          0.17788200
         30.63100000          0.00000000          0.62775600
         12.80100000          0.00000000          0.24763100
  1  0  0  1  1
          3.92690000          1.00000000
  1  0  0  1  1
          1.45230000          1.00000000
  1  0  0  1  1
          0.25620000          1.00000000
  1  0  0  1  1
          0.09430000          1.00000000
  1  0  0  1  1
          0.03470000          1.00000000
  1  1  1  6  1
        335.48000000          0.00361600
         78.90000000          0.02786600
         24.98800000          0.11867800
          9.21970000          0.29875000
          3.62110000          0.44119200
          1.45130000          0.31270100
  1  1  1  1  1
          0.50500000          1.00000000
  1  1  1  1  1
          0.18630000          1.00000000
  1  1  1  1  1
          0.06540000          1.00000000
  1  1  1  1  1
          0.02300000          1.00000000
  1  2  2  2  1
          0.50500000          0.22610000
          0.18630000          1.07590000
  1  2  2  2  1
          0.06540000          0.16360000
          0.02300000          0.10770000
# PHOSPHORUS  (14S,10P,4D) -> [7S,5P,2D]
P  Sadlej-pVTZ
 13
  1  0  0  8  2
      77492.43000000          0.00078700          0.00000000
      11605.79000000          0.00610900          0.00000000
       2645.96000000          0.03136800          0.00000000
        754.98000000          0.12429100          0.00000000
        248.75000000          0.38068200          0.00000000
         91.15700000          0.55998900          0.16399700
         36.22600000          0.00000000          0.62592700
         15.21100000          0.00000000          0.26221100
  1  0  0  1  1
          4.71380000          1.00000000
  1  0  0  1  1
          1.78270000          1.00000000
  1  0  0  1  1
          0.34250000          1.00000000
  1  0  0  1  1
          0.12460000          1.00000000
  1  0  0  1  1
          0.04530000          1.00000000
  1  1  1  6  1
        384.84000000          0.00037650
         90.55200000          0.02901000
         28.80600000          0.12295300
         10.68800000          0.30647000
          4.25210000          0.44134900
          1.74050000          0.29581700
  1  1  1  1  1
          0.59790000          1.00000000
  1  1  1  1  1
          0.22920000          1.00000000
  1  1  1  1  1
          0.08380000          1.00000000
  1  1  1  1  1
          0.03060000          1.00000000
  1  2  2  2  1
          0.59790000          0.30930000
          0.22920000          0.97150000
  1  2  2  2  1
          0.08380000          0.12780000
          0.03060000          0.07740000
# SULFUR      (14S,10P,4D) -> [7S,5P,2D]
S  Sadlej-pVTZ
 13
  1  0  0  8  2
      99413.40000000          0.00074200          0.00000000
      13961.70000000          0.00579000          0.00000000
       3169.90000000          0.02994100          0.00000000
        902.46000000          0.11897500          0.00000000
        297.16000000          0.36829000          0.00000000
        108.70200000          0.57748900          0.14293200
         43.15500000          0.00000000          0.62464900
         18.10800000          0.00000000          0.28340000
  1  0  0  1  1
          5.57050000          1.00000000
  1  0  0  1  1
          2.14270000          1.00000000
  1  0  0  1  1
          0.43400000          1.00000000
  1  0  0  1  1
          0.15700000          1.00000000
  1  0  0  1  1
          0.05680000          1.00000000
  1  1  1  6  1
        495.04000000          0.00317100
        117.22000000          0.02464300
         37.50700000          0.10784500
         13.91000000          0.28848900
          5.50450000          0.44810800
          2.24330000          0.32051700
  1  1  1  1  1
          0.77620000          1.00000000
  1  1  1  1  1
          0.29190000          1.00000000
  1  1  1  1  1
          0.10290000          1.00000000
  1  1  1  1  1
          0.03630000          1.00000000
  1  2  2  2  1
          0.77620000          0.29150000
          0.29190000          0.89660000
  1  2  2  2  1
          0.10290000          0.11380000
          0.03630000          0.05680000
# CHLORINE    (14S,10P,4D) -> [7S,5P,2D]
CL Sadlej-pVTZ
 13
  1  0  0  8  2
     105818.80000000          0.00074300          0.00000000
      15872.00000000          0.00575400          0.00000000
       3619.70000000          0.02967400          0.00000000
       1030.80000000          0.11799100          0.00000000
        339.91000000          0.36531900          0.00000000
        124.53800000          0.58114600          0.13754300
         49.51400000          0.00000000          0.62292000
         20.80600000          0.00000000          0.29010600
  1  0  0  1  1
          6.46480000          1.00000000
  1  0  0  1  1
          2.52540000          1.00000000
  1  0  0  1  1
          0.53780000          1.00000000
  1  0  0  1  1
          0.19350000          1.00000000
  1  0  0  1  1
          0.06960000          1.00000000
  1  1  1  6  1
        589.78000000          0.00298200
        139.85000000          0.02337500
         44.79500000          0.10399800
         16.61200000          0.28443000
          6.59950000          0.45068600
          2.71410000          0.32306400
  1  1  1  1  1
          0.95280000          1.00000000
  1  1  1  1  1
          0.35800000          1.00000000
  1  1  1  1  1
          0.12500000          1.00000000
  1  1  1  1  1
          0.04360000          1.00000000
  1  2  2  2  1
          0.95280000          0.28530000
          0.35800000          0.81690000
  1  2  2  2  1
          0.12500000          0.10130000
          0.04360000          0.04300000
# POTASSIUM   (15S,13P,4D) -> [9S,7P,2D]
K  Sadlej-pVTZ
 15
  1  0  0  9  3
     151351.90000000          0.00025850          0.00007450         -0.00002450
      22745.91000000          0.00199200          0.00056980         -0.00018820
       5227.16600000          0.01014690          0.00295990         -0.00097180
       1500.18800000          0.04036660          0.01176040         -0.00390390
        495.47030000          0.12730020          0.04002060         -0.01318970
        180.90080000          0.29858250          0.10237690         -0.03477070
         71.21769000          0.41850020          0.20508810         -0.07005520
         29.38428000          0.23708130          0.13515080         -0.05254560
          8.69924300          0.02020670         -0.50257140          0.24206320
  1  0  0  1  1
          3.47330400          1.00000000
  1  0  0  1  1
          0.81456200          1.00000000
  1  0  0  1  1
          0.31891500          1.00000000
  1  0  0  1  1
          0.03548400          1.00000000
  1  0  0  1  1
          0.01639000          1.00000000
  1  0  0  1  1
          0.00757000          1.00000000
  1  1  1  8  2
        868.39030000          0.00233510          0.00017880
        205.57650000          0.01875440          0.00576410
         65.91230000          0.08655860          0.02746990
         24.59863000          0.25027990          0.08139200
          9.88228100          0.43003970          0.15135980
          4.11675100          0.35114370          0.10827110
          1.55600400          0.06641970         -0.26193700
          0.61218800         -0.05125300         -0.58403100
  1  1  1  1  1
          0.22305300          1.00000000
  1  1  1  1  1
          0.08126000          1.00000000
  1  1  1  1  1
          0.02961000          1.00000000
  1  1  1  1  1
          0.01079000          1.00000000
  1  1  1  1  1
          0.00393000          1.00000000
  1  2  2  2  1
          0.61219000          0.57237000
          0.22305000          0.66528000
  1  2  2  2  1
          0.02961000          0.37658000
          0.01079000          0.37295000
# CALCIUM     (15S,13P,4D) -> [9S,7P,2D]
CA Sadlej-pVTZ
 15
  1  0  0  9  3
     171297.15000000          0.00025100         -0.00007310          0.00002510
      25997.43000000          0.00190900         -0.00055180          0.00019060
       5996.48000000          0.00973920         -0.00286960          0.00098530
       1714.73000000          0.03910600         -0.01151110          0.00399620
        563.65320000          0.12449940         -0.03947410          0.01360870
        204.94600000          0.29520870         -0.10212320          0.03628250
         80.45147000          0.41956110         -0.20617240          0.07376420
         33.14092000          0.24275360         -0.14147230          0.05758500
          9.87914600          0.02151540          0.49590070         -0.25268930
  1  0  0  1  1
          3.99467000          1.00000000
  1  0  0  1  1
          0.98534300          1.00000000
  1  0  0  1  1
          0.41161600          1.00000000
  1  0  0  1  1
          0.06560500          1.00000000
  1  0  0  1  1
          0.02674000          1.00000000
  1  0  0  1  1
          0.01062000          1.00000000
  1  1  1  8  2
       1003.02700000          0.00222070         -0.00072750
        237.82390000          0.01786480         -0.00585370
         76.56948000          0.08273140         -0.02794790
         28.73768000          0.24195210         -0.08405700
         11.63688000          0.42420780         -0.15902850
          4.90320800          0.35857820         -0.12159820
          1.92337000          0.07503820          0.24858350
          0.78005800          0.00451020          0.59543360
  1  1  1  1  1
          0.29376400          1.00000000
  1  1  1  1  1
          0.11063000          1.00000000
  1  1  1  1  1
          0.04166000          1.00000000
  1  1  1  1  1
          0.01569000          1.00000000
  1  1  1  1  1
          0.00591000          1.00000000
  1  2  2  2  1
          0.78006000          0.51870000
          0.29376000          0.56587000
  1  2  2  2  1
          0.04166000          0.33335000
          0.01569000          0.14089000
# BROMINE     (15S,12P,9D,4F) -> [9S,7P,4D,2F]
BR Sadlej-pVTZ
 17
  1  0  0 10  4
     379677.70000000          0.00038420         -0.00012080          0.00004800         -0.00001470
      56125.18000000          0.00300030         -0.00094110          0.00037490         -0.00011470
      12967.35000000          0.01489070         -0.00474420          0.00188270         -0.00057660
       3836.08200000          0.05477460         -0.01770260          0.00709770         -0.00217350
       1331.99600000          0.15677150         -0.05499180          0.02201390         -0.00675470
        508.04210000          0.33280990         -0.13338940          0.05533690         -0.01701640
        207.78120000          0.39856780         -0.23451110          0.09950580         -0.03086650
         90.42185000          0.17653680         -0.09721030          0.04981420         -0.01561800
         33.00437000          0.01249060          0.54259170         -0.35744090          0.11757500
         14.35639000         -0.00172190          0.57185840         -0.51718760          0.18286250
  1  0  0  1  1
          4.72852500          1.00000000
  1  0  0  1  1
          2.03296700          1.00000000
  1  0  0  1  1
          0.41270600          1.00000000
  1  0  0  1  1
          0.15614200          1.00000000
  1  0  0  1  1
          0.05907400          1.00000000
  1  1  1  8  3
       3167.91000000          0.00246430         -0.00099400          0.00025880
        762.50440000          0.01959070         -0.00795010          0.00204380
        249.39630000          0.09116940         -0.03828910          0.01003860
         95.23177000          0.26560200         -0.11691170          0.03024520
         39.92301000          0.43554300         -0.20901610          0.05658970
         17.78166000          0.31177610         -0.09683760          0.01958550
          7.67726400          0.06020910          0.35122830         -0.10565350
          3.34206400         -0.00199290          0.56985370         -0.22549650
  1  1  1  1  1
          1.44242200          1.00000000
  1  1  1  1  1
          0.44232000          1.00000000
  1  1  1  1  1
          0.13777200          1.00000000
  1  1  1  1  1
          0.04291300          1.00000000
  1  2  2  3  1
         96.15001000          0.02651280
         27.83908000          0.15006420
          9.85106700          0.38048960
  1  2  2  2  1
          3.61018700          0.48027720
          1.25154400          0.24788540
  1  2  2  2  1
          1.44240000          0.00395000
          0.44230000          0.80388000
  1  2  2  2  1
          0.13780000          0.13480000
          0.04290000          0.06231000
  1  3  3  2  1
         27.83910000          0.02844100
          9.85107000          0.12122800
  1  3  3  2  1
          3.61019000          0.25277100
          1.25154000          0.22157900
# RUBIDIUM    (18S,15P,10D) -> [11S,9P,4D]
RB Sadlej-pVTZ
 19
  1  0  0 11  4
     432918.40000000          0.00037020         -0.00011700          0.00004740          0.00001600
      65814.05000000          0.00279580         -0.00088250          0.00035770          0.00012080
      15362.04000000          0.01385200         -0.00442590          0.00179340          0.00060530
       4506.95000000          0.05253920         -0.01709230          0.00695990          0.00235420
       1533.26200000          0.15484700         -0.05424870          0.02222370          0.00750950
        581.09600000          0.32664490         -0.13182170          0.05535600          0.01883560
        240.21680000          0.39424630         -0.22703110          0.09919630          0.03379590
        106.11120000          0.18840790         -0.12106900          0.05908320          0.02088110
         40.82235000          0.01691090          0.45008930         -0.28498790         -0.10455660
         18.69521000         -0.00277380          0.60674180         -0.56166080         -0.21509890
          7.85089400          0.00154220          0.13097090          0.06893800          0.02617940
  1  0  0  1  1
          3.94615000          1.00000000
  1  0  0  1  1
          1.84403900          1.00000000
  1  0  0  1  1
          0.06921720          1.00000000
  1  0  0  1  1
          0.27676700          1.00000000
  1  0  0  1  1
          0.03889000          1.00000000
  1  0  0  1  1
          0.01963200          1.00000000
  1  0  0  1  1
          0.00991000          1.00000000
  1  1  1  9  3
       3772.36000000          0.00224900         -0.00093260         -0.00027990
        896.84980000          0.01841780         -0.00764860         -0.00228370
        291.17740000          0.08705500         -0.03758360         -0.01135210
        111.16650000          0.25735740         -0.11573930         -0.03489420
         46.59779000          0.43451480         -0.21569860         -0.06690170
         20.61947000          0.32479400         -0.10128430         -0.02586680
          8.54580300          0.06296000          0.38339830          0.14412410
          3.72780700         -0.00301060          0.57238880          0.25911670
          1.62608800          0.00227040          0.18499650         -0.02242420
  1  1  1  1  1
          0.60815400          1.00000000
  1  1  1  1  1
          0.21125700          1.00000000
  1  1  1  1  1
          0.07338500          1.00000000
  1  1  1  1  1
          0.02549200          1.00000000
  1  1  1  1  1
          0.00885500          1.00000000
  1  1  1  1  1
          0.00308000          1.00000000
  1  2  2  4  1
        132.33260000          0.01956850
         38.80142000          0.11893780
         14.10538000          0.32958700
          5.53661600          0.45462320
  1  2  2  2  1
          2.23966800          0.29737770
          0.85943200          0.05918200
  1  2  2  2  1
          0.60815000          0.08031000
          0.21126000          0.10313000
  1  2  2  2  1
          0.02549000          0.44488000
          0.00886000          0.37698000
# STRONTIUM   (18S,15P,10D) -> [11S,9P,4D]
SR Sadlej-pVTZ
 19
  1  0  0 11  4
     447503.80000000          0.00037980         -0.00012030         -0.00004910          0.00001740
      68033.85000000          0.00286610         -0.00090690         -0.00037080          0.00013180
      15907.65000000          0.01414740         -0.00453340         -0.00185360          0.00065780
       4680.18100000          0.05338980         -0.01741690         -0.00715570          0.00254670
       1596.10800000          0.15677030         -0.05516680         -0.02281190          0.00810370
        605.02680000          0.33004550         -0.13393850         -0.05678060          0.02034300
        249.66550000          0.39426210         -0.22989190         -0.10157800          0.03636980
        110.23710000          0.18288270         -0.11405300         -0.05636820          0.02115380
         42.34581000          0.01568870          0.46964200          0.30364050         -0.11807470
         19.32749000         -0.00261670          0.59824300          0.56731990          0.22897930
          7.94375200          0.00148320          0.12031880         -0.13577640          0.05482200
  1  0  0  1  1
          3.99792700          1.00000000
  1  0  0  1  1
          1.93331400          1.00000000
  1  0  0  1  1
          0.71633500          1.00000000
  1  0  0  1  1
          0.30581700          1.00000000
  1  0  0  1  1
          0.05487500          1.00000000
  1  0  0  1  1
          0.02294400          1.00000000
  1  0  0  1  1
          0.00959300          1.00000000
  1  1  1  9  3
       3942.23500000          0.00230060          0.00096470         -0.00031110
        935.36130000          0.01887990          0.00793810         -0.00254770
        303.60260000          0.08905800          0.03891590         -0.01263310
        115.89080000          0.26221620          0.11963390         -0.03880580
         48.56029000          0.43752720          0.22008900         -0.07343700
         21.49991000          0.31769830          0.09481260         -0.02521190
          8.94698400          0.05894890         -0.40425900          0.16581460
          3.86965000         -0.00251450         -0.58060630          0.28752600
          1.61773200          0.00198100         -0.15882060         -0.08079170
  1  1  1  1  1
          0.64198300          1.00000000
  1  1  1  1  1
          0.23849500          1.00000000
  1  1  1  1  1
          0.08876700          1.00000000
  1  1  1  1  1
          0.03303900          1.00000000
  1  1  1  1  1
          0.01229700          1.00000000
  1  1  1  1  1
          0.00457700          1.00000000
  1  2  2  4  1
        137.77420000          0.02082950
         40.44428000          0.12589180
         14.68809000          0.34435740
          5.75212900          0.46147100
  1  2  2  2  1
          2.32495500          0.27626760
          0.88911100          0.04438420
  1  2  2  2  1
          0.64198000          0.83492000
          0.23850000          0.80831000
  1  2  2  2  1
          0.03304000          0.39400000
          0.01230000          0.11109000
# IODINE      (19S,15P,12D,4F) -> [11S,9P,6D,2F]
I  Sadlej-pVTZ
 19
  1  0  0 13  5
    1024924.80000000         -0.00031120          0.00010120         -0.00004510         -0.00002030          0.00000690
     154843.13000000         -0.00238220          0.00077360         -0.00034510         -0.00015560          0.00005290
      35646.33600000         -0.01210280          0.00397840         -0.00177150         -0.00079920          0.00027190
      10272.63000000         -0.04739060          0.01582010         -0.00709610         -0.00320170          0.00108830
       3434.47690000         -0.14435740          0.05179790         -0.02330840         -0.01054490          0.00359000
       1284.43130000         -0.31644810          0.12988120         -0.06026250         -0.02735820          0.00930650
        525.64189000         -0.40189880          0.23403130         -0.11246510         -0.05169880          0.01767380
        230.74127000         -0.20585810          0.13785890         -0.07617240         -0.03557510          0.01210960
         87.25521700         -0.01951780         -0.47045900          0.35156800          0.17534850         -0.06059020
         39.49446400          0.00351050         -0.62441440          0.64497580          0.35783470         -0.12752780
         14.25452000         -0.00215030         -0.11868340         -0.41409940         -0.32857720          0.12801440
          7.64660890          0.00190770          0.03771190         -0.80842900         -0.92020060          0.37253770
          3.05005980         -0.00171740         -0.02476350         -0.15597730          0.24782610         -0.13940910
  1  0  0  1  1
          1.73261810          1.00000000
  1  0  0  1  1
          0.87682360          1.00000000
  1  0  0  1  1
          0.63499300          1.00000000
  1  0  0  1  1
          0.25649760          1.00000000
  1  0  0  1  1
          0.10611690          1.00000000
  1  0  0  1  1
          0.04390220          1.00000000
  1  1  1 10  4
       7299.04100000          0.00263160          0.00122930          0.00053660          0.00015990
       1767.86710000          0.02049250          0.00967380          0.00422850          0.00126120
        590.09433000          0.09320570          0.04558810          0.02008670          0.00599460
        231.49387000          0.26163390          0.13561190          0.06039740          0.01807690
        101.73176000          0.41588470          0.23456620          0.10674460          0.03200640
         47.56911900          0.31281820          0.12012920          0.04674670          0.01372830
         22.27540400          0.07148570         -0.34953750         -0.22011500         -0.07006300
         10.84089700          0.00109600         -0.58376400         -0.42079030         -0.13605430
          5.23794980          0.00063450         -0.20620120          0.06285800          0.03812520
          2.54663340         -0.00038110         -0.85723060          0.64345010          0.27009600
  1  1  1  1  1
          1.21068480          1.00000000
  1  1  1  1  1
          0.57440920          1.00000000
  1  1  1  1  1
          0.24653310          1.00000000
  1  1  1  1  1
          0.09135320          1.00000000
  1  1  1  1  1
          0.03385110          1.00000000
  1  2  2  4  2
        370.37639000          0.01607890          0.00666480
        109.71047000          0.10913290          0.04617800
         41.19921600          0.32774670          0.14050370
         17.28460700          0.46584060          0.18651160
  1  2  2  4  2
          7.81544150          0.26401570          0.01089200
          3.74281530          0.04389700          0.38274730
          1.65958780          0.00308300          0.52593280
          0.65265910         -0.00042300          0.22223190
  1  2  2  2  1
          0.57440900          0.24806500
          0.24653300          1.07295300
  1  2  2  2  1
          0.09135300          0.13663400
          0.03385100          0.05436000
  1  3  3  2  1
          7.81544150          0.00389600
          3.74281530          0.19783900
  1  3  3  2  1
          1.65958780          0.40825400
          0.65265910          0.27508300
# BASIS="Roos Augmented Double Zeta ANO"
#Elements                             References
#--------                             ----------
#H - Ne:  P.O. Widmark, P.A. Malmqvist, B. Roos, Theor. Chim. Acta, 77,
#         291 (1990).
#Na - Ar: P.O. Widmark, B. J. Persson and B. Roos Theor. Chim. Acta, 79,
#         419 (1991).
#Sc - Zn: R. Pou-Amerigo, M. Merchan, I. Nebot-Gil, P.O. Widmark and B. Roos,
#         Theor. Chim. Acta, 92, 149 (1995).
#
# HYDROGEN    (8s,4p) -> [3s,2p]
H  Roos-ADZ-ANO
  2
  1  0  0  8  3
        188.61445000          0.00096390         -0.00131190          0.00242240
         28.27659600          0.00749200         -0.01034510          0.02033820
          6.42483000          0.03759540         -0.05049530          0.08963940
          1.81504100          0.14339500         -0.20738550          0.44229070
          0.59106300          0.34863630         -0.43508850          0.57571440
          0.21214900          0.43829740         -0.02472970         -0.98028900
          0.07989100          0.16510660          0.32252600         -0.67215380
          0.02796200          0.02102290          0.70727540          1.14176850
  1  1  1  4  2
          2.30500000          0.11279020         -0.21086880
          0.80675000          0.41850750         -0.59437960
          0.28236200          0.47000770          0.08968890
          0.09882700          0.18262600          0.86116340
# HELIUM      (9s,4p) -> [3s,2p]
HE Roos-ADZ-ANO
  2
  1  0  0  9  3
       1149.27050000          0.00035774         -0.00053060          0.00070544
        172.04457000          0.00277289         -0.00403300          0.00705199
         39.08046500          0.01429838         -0.02258040          0.03126037
         11.03617300          0.05586749         -0.10262550          0.32197965
          3.56415200          0.16336284         -0.45771141          1.00474880
          1.24044300          0.33133146         -0.60596530         -1.29080400
          0.44731600          0.41429728          0.57131336         -0.47258960
          0.16420600          0.18903228          0.54758341          0.95308829
          0.05747200          0.00515606          0.01165900          0.05061692
  1  1  1  4  2
          4.55000000          0.08926060         -0.18673500
          1.59250000          0.38050238         -0.51173450
          0.55737500          0.44912372         -0.19815060
          0.19508100          0.27765440          0.99587976
# LITHIUM     (14s,9p,4d) -> [4s,3p,2d]
LI Roos-ADZ-ANO
  3
  1  0  0 14  4
       9497.93440000          0.00007470         -0.00001100          0.00000640         -0.00004010
       1416.81120000          0.00058360         -0.00008570          0.00004890         -0.00031020
        321.45994000          0.00306100         -0.00045070          0.00026580         -0.00164650
         91.12416300          0.01260110         -0.00186300          0.00106850         -0.00663950
         29.99989100          0.04234720         -0.00635750          0.00397710         -0.02266020
         11.01763100          0.11475800         -0.01776730          0.01120300         -0.05824470
          4.37280100          0.23936590         -0.03979680          0.03121890         -0.12226070
          1.83125600          0.35759180         -0.07012820          0.06165080         -0.13524710
          0.80226100          0.30337580         -0.10294690          0.15065020         -0.05426510
          0.36264800          0.08637930         -0.09370780          0.18747830          0.08320130
          0.11399500          0.00264390          0.22012880         -1.09410700          1.74793500
          0.05123700          0.00121700          0.59337740         -0.29242230         -1.64630700
          0.02246800          0.00056200          0.29452750          0.84809440         -0.74085420
          0.00786000          0.00001970          0.02495030          0.44800090          1.30386500
  1  1  1  9  3
         13.11950400          0.00144900         -0.00232680          0.00948250
          3.07742420          0.00799580         -0.01122420          0.06320780
          1.09880050          0.02134850         -0.03446260          0.17514660
          0.43577840          0.05011950         -0.03387750          0.57689390
          0.18024320          0.19547390         -0.45445200          0.55635160
          0.07613330          0.41911190         -0.49630840         -1.29108200
          0.03254650          0.34816470          0.48858790          0.20705210
          0.01401820          0.15059750          0.56023390          0.42867280
          0.00490640          0.01570330          0.07028070          0.00433120
  1  2  2  4  2
          0.45000000          0.02237290         -0.03046180
          0.15750000          0.37508790         -0.57345880
          0.05512500          0.46891730         -0.27418710
          0.01929380          0.36536290          0.95628830
# BERYLLIUM   (14s,9p,4d) -> [4s,3p,2d]
BE Roos-ADZ-ANO
  3
  1  0  0 14  4
      22628.59900000          0.00005330         -0.00001020          0.00001240         -0.00001630
       3372.31810000          0.00041810         -0.00008040          0.00009760         -0.00010870
        760.35040000          0.00222600         -0.00042810          0.00051670         -0.00072720
        211.74048000          0.00956280         -0.00184870          0.00225260         -0.00232140
         67.22346800          0.03481790         -0.00680080          0.00822820         -0.01240240
         23.37217700          0.10594610         -0.02137190          0.02644130         -0.02509110
          8.72137300          0.24566320         -0.05303520          0.06578970         -0.11646220
          3.46809100          0.38607360         -0.10045770          0.13010640         -0.06311670
          1.45214400          0.31037320         -0.13751390          0.19754920         -0.67003370
          0.60861500          0.06389400         -0.06507040          0.07492650          1.22635800
          0.25768600         -0.00153140          0.32457320         -1.38872200          1.07468780
          0.10417600          0.00118250          0.61816430          0.15458290         -2.96245500
          0.04242700         -0.00025210          0.20476750          1.02601810          1.56000350
          0.01484900          0.00007380          0.00430350          0.02577770          0.28184410
  1  1  1  9  3
         33.71018400          0.00103780         -0.00121420          0.00258730
          8.05764950          0.00660870         -0.00561260          0.02089540
          2.83647140          0.02155900         -0.02547970          0.05737160
          1.09996570          0.06087780         -0.01144150          0.26426850
          0.44339640          0.20355730         -0.51385070          1.06476000
          0.18222640          0.45796690         -0.49080920         -1.43630700
          0.07572410          0.36859060          0.72214520         -0.05473260
          0.03168540          0.06306410          0.43076220          0.77703460
          0.01108990          0.00210970          0.00225560         -0.03205040
  1  2  2  4  2
          1.40000000          0.00667730         -0.01038680
          0.49000000          0.24681340          0.89258070
          0.17150000          0.65744630         -0.15070990
          0.06002500          0.25351910         -0.68121650
# BORON       (14s,9p,4d) -> [4s,3p,2d]
B  Roos-ADZ-ANO
  3
  1  0  0 14  4
      33360.21700000          0.00005830         -0.00001210          0.00001210         -0.00001800
       4972.09520000          0.00045650         -0.00009500          0.00009450         -0.00012920
       1125.64170000          0.00240890         -0.00050280          0.00049970         -0.00077710
        316.49136000          0.01016310         -0.00212640          0.00211920         -0.00278200
        102.00726000          0.03609550         -0.00767440          0.00765190         -0.01256000
         36.29587300          0.10598100         -0.02321790          0.02340450         -0.03012700
         13.97141000          0.23956540         -0.05694680          0.05811560         -0.11132910
          5.74115600          0.37377260         -0.10625770          0.11167390         -0.10474970
          2.49426800          0.30814650         -0.14576940          0.17056230         -0.45988410
          1.11420200          0.07769280         -0.04302850          0.01726760          0.67401790
          0.42154900          0.00147970          0.37194410         -0.99890440          1.50425190
          0.16963300          0.00049910          0.56520900         -0.22657220         -2.47604300
          0.06853500         -0.00002620          0.19212690          1.02945500          0.57766700
          0.02398700          0.00002360          0.02191280          0.22137860          0.74299930
  1  1  1  9  3
         55.00000000          0.00101860         -0.00077760          0.00075900
         13.36610100          0.00739580         -0.00577680          0.00591510
          4.13539400          0.03225140         -0.02261340          0.01360090
          1.48125600          0.09834640         -0.06968340          0.03206280
          0.60213600          0.23180240         -0.25511460          0.62952610
          0.25563600          0.34124360         -0.36077860          0.17326490
          0.11115100          0.29329830          0.06123950         -0.89178530
          0.04764800          0.16959510          0.29599380         -0.35355500
          0.01667700          0.15075690          0.66292780          0.84690410
  1  2  2  4  2
          1.20000000          0.08034580         -0.12246280
          0.42000000          0.42193580         -0.56047330
          0.14700000          0.46391670         -0.08942600
          0.05145000          0.28557340          0.90159380
# CARBON      (14s,9p,4d) -> [4s,3p,2d]
C  Roos-ADZ-ANO
  3
  1  0  0 14  4
      50557.50100000          0.00005530         -0.00001200          0.00001190         -0.00001560
       7524.78560000          0.00043430         -0.00009400          0.00009270         -0.00011400
       1694.32760000          0.00231590         -0.00050280          0.00049890         -0.00067310
        472.82279000          0.00987290         -0.00214760          0.00211800         -0.00253230
        151.71075000          0.03521950         -0.00779420          0.00777840         -0.01090030
         53.91874600          0.10419380         -0.02376340          0.02363280         -0.02778070
         20.65931100          0.24127410         -0.06002350          0.06163060         -0.09587130
          8.38397600          0.38401740         -0.11539850          0.11896800         -0.12478060
          3.57701500          0.30823710         -0.15390090          0.18806210         -0.39324600
          1.54711800          0.06830550         -0.01459460         -0.05403040          0.67960040
          0.61301300          0.00077820          0.38958490         -0.98141370          1.19786900
          0.24606800          0.00099050          0.53972910         -0.10967580         -1.89795200
          0.09908700         -0.00008930          0.18840600          0.88473560         -0.00446140
          0.03468000          0.00004710          0.02585750          0.29649830          1.01421480
  1  1  1  9  3
         83.33315500          0.00122410         -0.00114440          0.00146690
         19.55761100          0.00943890         -0.00897960          0.01445530
          6.08036500          0.04177440         -0.03784560          0.04663730
          2.17931700          0.13183300         -0.12927080          0.23665370
          0.86515000          0.27891190         -0.37840220          0.60887340
          0.36194400          0.36686630         -0.26921370         -0.39177930
          0.15474000          0.27905910          0.29175420         -0.87002290
          0.06542900          0.13804810          0.54366980          0.42005050
          0.02290000          0.03419500          0.26283080          0.57994970
  1  2  2  4  2
          1.90000000          0.09873120         -0.14550130
          0.66500000          0.45296610         -0.50768090
          0.23275000          0.43624570         -0.10156300
          0.08146300          0.27192500          0.92519220
# NITROGEN    (14s,9p,4d) -> [4s,3p,2d]
N  Roos-ADZ-ANO
  3
  1  0  0 14  4
      74761.71500000          0.00005020         -0.00001120          0.00000970         -0.00001210
      11123.65400000          0.00039460         -0.00008780          0.00007650         -0.00009030
       2512.68570000          0.00208850         -0.00046670          0.00040480         -0.00051790
        703.77729000          0.00890790         -0.00199310          0.00173980         -0.00200460
        225.47879000          0.03208840         -0.00730330          0.00634560         -0.00836000
         79.61581000          0.09744740         -0.02282590          0.02014050         -0.02274400
         30.23728300          0.23178950         -0.05922070          0.05240310         -0.07448660
         12.26362200          0.37769110         -0.11561210          0.10665170         -0.11086000
          5.26508600          0.31879170         -0.15650830          0.15833880         -0.29833890
          2.33347100          0.08237820         -0.02310580         -0.00500510          0.32128220
          0.90185600          0.00279050          0.37564760         -0.84187200          1.17102980
          0.35833600          0.00024650          0.54576530         -0.15905630         -0.86495620
          0.14109300         -0.00002890          0.21035430          0.59120260         -1.22379300
          0.04938300          0.00000970          0.01278950          0.57660530          1.44458050
  1  1  1  9  3
        126.66657000          0.00114230         -0.00095650          0.00142010
         29.83738900          0.00895910         -0.00757630          0.01254390
          9.39403800          0.04053750         -0.03369470          0.05099130
          3.40510400          0.12949010         -0.11334370          0.20571180
          1.35000000          0.27678080         -0.30554980          0.54520410
          0.55769600          0.36888890         -0.27339530         -0.15225420
          0.23244900          0.29346190          0.20192520         -0.83771660
          0.09426400          0.12846830          0.49253440          0.04965950
          0.03299200          0.03905860          0.40980120          0.74594410
  1  2  2  4  2
          2.75000000          0.12053068         -0.17333210
          0.96250000          0.50760685         -0.47399030
          0.33687500          0.44539556          0.03678810
          0.11790600          0.15876917          0.89316126
# OXYGEN      (14s,9p,4d) -> [4s,3p,2d]
O  Roos-ADZ-ANO
  3
  1  0  0 14  4
     105374.95000000          0.00004590         -0.00001050          0.00000900         -0.00001090
      15679.24000000          0.00036070         -0.00008250          0.00007050         -0.00008220
       3534.54470000          0.00191980         -0.00044120          0.00037570         -0.00046750
        987.36516000          0.00820670         -0.00188640          0.00161460         -0.00184650
        315.97875000          0.02972570         -0.00695400          0.00593400         -0.00755850
        111.65428000          0.09045580         -0.02172080          0.01878660         -0.02108680
         42.69945100          0.21740540         -0.05685130          0.04946830         -0.06675110
         17.39559600          0.36876570         -0.11396350          0.10303990         -0.10936730
          7.43830900          0.33727980         -0.16202010          0.16205860         -0.27314310
          3.22286200          0.09675050         -0.03338000          0.00093670          0.20971370
          1.25387700          0.00256740          0.36550680         -0.82242510          1.20348070
          0.49515500          0.00137460          0.55200310         -0.10179020         -0.67746940
          0.19166500         -0.00014100          0.22363930          0.42539390         -1.42988400
          0.06708300          0.00006830          0.00657450          0.68770280          1.48910680
  1  1  1  9  3
        200.00000000          0.00089330         -0.00083840          0.00126180
         46.53336700          0.00736900         -0.00684910          0.01116280
         14.62180900          0.03493920         -0.03285050          0.05183160
          5.31306400          0.11529850         -0.11000600          0.19788450
          2.10252500          0.25832310         -0.31352630          0.57076520
          0.85022300          0.36962310         -0.31960110         -0.17892910
          0.33759700          0.32387890          0.22172430         -0.89820770
          0.12889200          0.14679890          0.56226160          0.26666430
          0.04511200          0.03361270          0.30132510          0.62589940
  1  2  2  4  2
          3.75000000          0.12849340         -0.21820550
          1.31250000          0.52118840         -0.48176950
          0.45937500          0.43457840          0.13575950
          0.16078100          0.14574090          0.82977340
# FLUORINE    (14s,9p,4d) -> [4s,3p,2d]
F  Roos-ADZ-ANO
  3
  1  0  0 14  4
     103109.46000000          0.00006370         -0.00001480          0.00001510         -0.00001540
      15281.00700000          0.00050280         -0.00011720          0.00011870         -0.00011600
       3441.53920000          0.00266770         -0.00062390          0.00063630         -0.00065960
        967.09483000          0.01120030         -0.00262800          0.00265990         -0.00255000
        314.03534000          0.03909800         -0.00935030          0.00960680         -0.01023610
        113.44230000          0.11226570         -0.02784900          0.02843360         -0.02676290
         44.64472700          0.24720420         -0.06768800          0.07198310         -0.08293450
         18.94287400          0.36803450         -0.12305420          0.13103930         -0.11416490
          8.53274300          0.29086170         -0.15221800          0.20316170         -0.31608660
          3.91940100          0.07810240         -0.00757940         -0.09159900          0.44872390
          1.56815700          0.00354030          0.37593130         -1.00702500          1.16053510
          0.62329000          0.00091570          0.54384820          0.01746270         -1.36957000
          0.24086100          0.00007650          0.21277460          0.74900270         -0.60414010
          0.08430100          0.00002050          0.00664220          0.34476920          1.29671020
  1  1  1  9  3
        245.33029000          0.00098800         -0.00097930          0.00140030
         56.91900500          0.00829110         -0.00834100          0.01356230
         17.60456800          0.04073900         -0.04074570          0.06060520
          6.27499500          0.13533040         -0.14552660          0.26782200
          2.44703000          0.28096370         -0.35562750          0.58183690
          0.99506000          0.35883510         -0.25371630         -0.42803960
          0.40397300          0.30381120          0.28087000         -0.79915710
          0.15481000          0.13893790          0.56520350          0.46852140
          0.05418400          0.02581860          0.23237080          0.48624410
  1  2  2  4  2
          5.00000000          0.13035590         -0.28336550
          1.75000000          0.52550550         -0.53295890
          0.61250000          0.44216400          0.33934740
          0.21437500          0.12327470          0.67721890
# NEON        (14s,9p,4d) -> [4s,3p,2d]
NE Roos-ADZ-ANO
  3
  1  0  0 14  4
     166165.08000000          0.00004720         -0.00001110          0.00001380         -0.00001340
      23107.52400000          0.00040070         -0.00009420          0.00011550         -0.00010150
       5060.15390000          0.00219320         -0.00051800          0.00064920         -0.00065470
       1384.61230000          0.00958760         -0.00226650          0.00276320         -0.00232050
        436.51258000          0.03507340         -0.00845930          0.01073360         -0.01138250
        153.47148000          0.10465170         -0.02604860          0.03183250         -0.02534250
         59.38908700          0.23771230         -0.06535970          0.08719600         -0.10583830
         24.86196700          0.36960610         -0.12226570          0.15298110         -0.09837220
         11.01570400          0.30616090         -0.15857100          0.28479790         -0.52302700
          4.96517500          0.08419850         -0.00602870         -0.19295490          1.12262340
          1.93650300          0.00370350          0.38289570         -1.32258800          0.49014010
          0.76572800          0.00096540          0.53886490          0.49012790         -1.73790500
          0.29553800          0.00005400          0.21144870          0.75461750          0.39778720
          0.10343800          0.00002680          0.00280490          0.06136710          0.89004130
  1  1  1  9  3
        234.94500000          0.00158260         -0.00221020          0.00339890
         55.07738500          0.01257670         -0.01851140          0.03630470
         17.38954900          0.05698650         -0.08152120          0.14392890
          6.38953700          0.16812300         -0.29235700          0.73364640
          2.54208200          0.30738600         -0.54030600         -0.10766930
          1.03376400          0.35831120          0.09151550         -1.21431500
          0.41878800          0.27869380          0.60908800          0.64108330
          0.16462700          0.09521110          0.24352740          0.35686170
          0.05761900          0.00210200          0.00713030          0.01895010
  1  2  2  4  2
          6.42000000          0.13708560         -0.42047260
          2.24700000          0.54471000         -0.55929570
          0.78645000          0.44972740          0.70000990
          0.27525750          0.06537090          0.33900230
# SODIUM      (17s,12p,5d) -> [5s,4p,2d]
NA Roos-ADZ-ANO
  3
  1  0  0 17  5
     138773.72000000          0.00007636         -0.00001870          0.00000255         -0.00000230          0.00000364
      20325.89900000          0.00052939         -0.00012910          0.00001760         -0.00001600          0.00002582
       5878.60490000          0.00183722         -0.00045110          0.00006160         -0.00005530          0.00008615
       2015.43730000          0.00653431         -0.00159820          0.00021769         -0.00019860          0.00032753
        739.62658000          0.02092231         -0.00521350          0.00071184         -0.00063400          0.00100249
        280.82116000          0.06426610         -0.01627270          0.00221369         -0.00199710          0.00347727
        108.71501000          0.17089923         -0.04645830          0.00632867         -0.00546590          0.00977528
         42.60157200          0.35610342         -0.11144450          0.01509121         -0.01276240          0.02880208
         16.82981700          0.40213461         -0.18537340          0.02530901         -0.01876960          0.05266945
          6.68644860          0.12746393         -0.06005440          0.00808949         -0.00747550          0.02852077
          2.66748770          0.00061064          0.35924086         -0.05305070          0.03897469         -0.18124290
          1.06746210          0.00338457          0.57207971         -0.11164110          0.08327536         -0.14683560
          0.42818910         -0.00132870          0.22321420         -0.13831340          0.20560497         -0.33984270
          0.17208010          0.00085748         -0.00502860         -0.02990100         -0.04683150          0.65955083
          0.06925880         -0.00047610          0.00595957          0.44900485         -0.79823140          1.85913770
          0.02790920          0.00022186         -0.00253770          0.47484493         -0.57595290         -3.55761200
          0.01116330         -0.00006380          0.00078635          0.22905052          1.44086540          1.88655310
  1  1  1 12  4
        383.79172000          0.00102867         -0.00011860          0.00015162         -0.00018580
         94.39807200          0.00743093         -0.00086340          0.00110681         -0.00115460
         32.36150700          0.03273646         -0.00379970          0.00487773         -0.00606080
         12.05435200          0.11687036         -0.01384260          0.01792042         -0.01828510
          4.64171860          0.27753763         -0.03315040          0.04350073         -0.05598100
          1.81728760          0.39800015         -0.04899740          0.06554272         -0.05672000
          0.71827120          0.32331086         -0.04658270          0.07245938         -0.15067210
          0.28558030          0.09433492         -0.03024570          0.09073829         -0.00335500
          0.11399470          0.00109373          0.22294313         -0.76763740          1.54882680
          0.04562920          0.00178158          0.50923252         -0.39771490         -1.89946400
          0.01830100         -0.00069800          0.37196823          0.92303779          0.39892154
          0.00732040          0.00022539          0.04475107          0.17065606          0.64929030
  1  2  2  5  2
          0.86260360          0.02177426         -0.01348600
          0.34514180         -0.00721860         -0.00299870
          0.13809690          0.33517471         -0.46667530
          0.05525480          0.36379749         -0.62374900
          0.02210190          0.49254995          1.10909490
# MAGNESIUM   (17s,12p,5d) -> [5s,4p,2d]
MG Roos-ADZ-ANO
  3
  1  0  0 17  5
     169973.87000000          0.00007417         -0.00001880          0.00000379         -0.00000440          0.00000684
      24699.06600000          0.00051736         -0.00013060          0.00002638         -0.00003080          0.00004631
       7175.48510000          0.00177276         -0.00045010          0.00009109         -0.00010460          0.00016849
       2478.79200000          0.00623864         -0.00157940          0.00031906         -0.00037490          0.00054725
        917.73259000          0.01976587         -0.00509070          0.00103163         -0.00118030          0.00193137
        351.75140000          0.06017463         -0.01575210          0.00318903         -0.00375480          0.00545737
        137.51557000          0.16016295         -0.04484030          0.00913931         -0.01046200          0.01729461
         54.43028600          0.33917581         -0.10853870          0.02227591         -0.02638960          0.03812473
         21.72256900          0.40883352         -0.18759800          0.03965557         -0.04506790          0.07914147
          8.71944840          0.15183413         -0.08683860          0.01868253         -0.02557030          0.01594961
          3.51471660          0.00195927          0.33464216         -0.08001640          0.10765675         -0.13968240
          1.42121320          0.00418518          0.59813818         -0.18827570          0.21164824         -0.53435960
          0.57607650         -0.00187660          0.23180428         -0.21162620          0.43129749         -0.28133200
          0.23395250          0.00120338         -0.00693860          0.14066560         -0.96823710          3.08684680
          0.09515600         -0.00067450          0.00680179          0.68477064         -0.97343960         -3.53760100
          0.03875100          0.00031460         -0.00280300          0.34545022          1.46805860          1.02585020
          0.01550040         -0.00008880          0.00083003          0.00874972          0.09800990          0.56587909
  1  1  1 12  4
        557.13078000          0.00079833         -0.00016120          0.00013230         -0.00021600
        135.48388000          0.00589231         -0.00119310          0.00094881         -0.00048420
         47.21295800          0.02583591         -0.00524640          0.00431193         -0.00750940
         18.00095500          0.09406296         -0.01931180          0.01513244         -0.00373040
          7.11466070          0.24134480         -0.05049450          0.04187188         -0.07988840
          2.86302400          0.38746464         -0.08296280          0.06595574          0.01126479
          1.16401850          0.35595067         -0.08827490          0.09294055         -0.56057880
          0.47630470          0.12288168         -0.03970790          0.05017503          0.66659154
          0.19573560          0.00380787          0.42165449         -0.75622220          1.23752910
          0.08067830          0.00230283          0.58978450         -0.18127870         -2.36745000
          0.03332660         -0.00085890          0.10380275          1.03897020          1.29736030
          0.01333060          0.00027579          0.00502440          0.09524704          0.07151495
  1  2  2  5  2
          1.04456440          0.01605667         -0.04289690
          0.48574730          0.02264646          0.18907793
          0.22588410          0.46449386          0.77129122
          0.10504150          0.47219231         -0.32119970
          0.04201660          0.16336646         -0.76069020
# ALUMINUM    (17s,12p,5d) -> [5s,4p,2d]
AL Roos-ADZ-ANO
  3
  1  0  0 17  5
     208459.49000000          0.00007078         -0.00001840          0.00000432         -0.00000430          0.00000648
      29971.59800000          0.00049759         -0.00012920          0.00003029         -0.00003050          0.00004502
       8764.45650000          0.00167444         -0.00043710          0.00010265         -0.00010220          0.00015532
       3060.70730000          0.00580246         -0.00151200          0.00035421         -0.00035890          0.00052217
       1147.49630000          0.01811648         -0.00479430          0.00112743         -0.00111920          0.00171468
        445.75595000          0.05440537         -0.01462910          0.00343446         -0.00348670          0.00506469
        176.70642000          0.14492054         -0.04143990          0.00980341         -0.00974050          0.01501684
         70.94362000          0.31321200         -0.10118870          0.02408671         -0.02459030          0.03577722
         28.72400000          0.41334250         -0.18447700          0.04527494         -0.04498180          0.07132737
         11.69892300          0.19059653         -0.12273700          0.03095121         -0.03404100          0.04282415
          4.78536970          0.00707487          0.27348316         -0.07575180          0.08910950         -0.13355890
          1.96375180          0.00484032          0.61530733         -0.22480450          0.22809994         -0.44484980
          0.80785940         -0.00233010          0.28146024         -0.25485420          0.38525013         -0.52149340
          0.33299060          0.00153518         -0.00503600          0.20149503         -0.80088860          2.94805910
          0.13746930         -0.00086880          0.00796206          0.68310534         -0.99962600         -2.57699600
          0.05682380          0.00040223         -0.00353640          0.30782923          1.19801100         -0.19367300
          0.02272950         -0.00011120          0.00100247          0.02408008          0.36451428          1.10610360
  1  1  1 12  4
        677.76458000          0.00079717         -0.00013730          0.00015515         -0.00016860
        164.83442000          0.00589941         -0.00101230          0.00113147         -0.00108570
         57.68342400          0.02586307         -0.00449520          0.00508163         -0.00558830
         22.10867400          0.09471373         -0.01657140          0.01841598         -0.01713210
          8.78775140          0.24484796         -0.04414490          0.05014804         -0.05622460
          3.55708740          0.39837993         -0.07248030          0.08138367         -0.07224890
          1.45487800          0.35294610         -0.07465500          0.09799899         -0.16960580
          0.59893630          0.10280005          0.01880214         -0.01844020          0.10547020
          0.24763730          0.00234580          0.27739515         -0.62774810          1.09587210
          0.10269950          0.00175805          0.44207475         -0.24598520         -0.80230420
          0.04268530         -0.00053410          0.29055057          0.35129892         -0.92384590
          0.01707410          0.00019528          0.16625332          0.65543563          1.16081480
  1  2  2  5  2
          1.26731440          0.01856849         -0.00676530
          0.50951300          0.11745821          0.20578256
          0.20484530          0.50149748          0.54053298
          0.08235630          0.37968233         -0.08920980
          0.03294250          0.20021391         -0.87110670
# SILICON     (17s,12p,5d) -> [5s,4p,2d]
SI Roos-ADZ-ANO
  3
  1  0  0 17  5
     250095.97000000          0.00006815         -0.00001820          0.00000470         -0.00000490          0.00000688
      35803.20000000          0.00048017         -0.00012780          0.00003305         -0.00003480          0.00004735
      10522.48300000          0.00159626         -0.00042650          0.00011064         -0.00011490          0.00016522
       3701.77450000          0.00547507         -0.00146180          0.00037778         -0.00040070          0.00053088
       1399.39330000          0.01693706         -0.00458450          0.00119120         -0.00123290          0.00179852
        548.38895000          0.05041784         -0.01387010          0.00359228         -0.00382010          0.00503523
        219.36269000          0.13450267         -0.03917820          0.01024273         -0.01061380          0.01559960
         88.88225900          0.29476401         -0.09635060          0.02530364         -0.02708780          0.03568620
         36.32337700          0.41279726         -0.18176200          0.04932521         -0.05122020          0.07863781
         14.93346300          0.21885760         -0.14523390          0.04049616         -0.04663010          0.04948931
          6.16634850          0.01352631          0.22989807         -0.06985640          0.09190140         -0.11137450
          2.55455650          0.00478761          0.62379847         -0.25411200          0.26901327         -0.55229290
          1.06095070         -0.00235090          0.31543582         -0.28611330          0.46077703         -0.38840900
          0.44150240          0.00157700         -0.00276260          0.24639415         -1.05620100          2.95347820
          0.18401680         -0.00091180          0.00903722          0.68019181         -0.78471120         -2.85560200
          0.07679620          0.00041644         -0.00390620          0.28966706          1.20426300          0.09215286
          0.03071850         -0.00011400          0.00111144          0.02414823          0.29679859          1.03482600
  1  1  1 12  4
        843.53382000          0.00074369         -0.00015740          0.00016602         -0.00019250
        204.90726000          0.00552015         -0.00116560          0.00119789         -0.00115190
         72.24878700          0.02411287         -0.00515290          0.00545750         -0.00647660
         27.96136500          0.08883573         -0.01917230          0.01962832         -0.01827540
         11.23228200          0.23494251         -0.05231320          0.05586579         -0.06800600
          4.59693730          0.39732250         -0.09000870          0.09197956         -0.07758320
          1.90148330          0.36181185         -0.09250120          0.11503921         -0.21432990
          0.79178280          0.10524773          0.03870909         -0.06483660          0.25572048
          0.33116620          0.00256555          0.34152769         -0.68318220          1.07773340
          0.13894230          0.00177329          0.46110561         -0.16360950         -1.24468400
          0.05842570         -0.00045410          0.25855921          0.61750164         -0.38355030
          0.02337030          0.00017881          0.07566560          0.44097775          1.02251980
  1  2  2  5  2
          2.01053330          0.02221051         -0.00195270
          0.79109810          0.10356980          0.15356092
          0.31127870          0.50813164          0.48959332
          0.12248090          0.35117535          0.11387560
          0.04899240          0.25071127         -0.98489900
# PHOSPHORUS  (17s,12p,5d) -> [5s,4p,2d]
P  Roos-ADZ-ANO
  3
  1  0  0 17  5
     296647.55000000          0.00006562         -0.00001780          0.00000495         -0.00000380          0.00000594
      42380.03000000          0.00046254         -0.00012560          0.00003483         -0.00002680          0.00004144
      12503.85600000          0.00152412         -0.00041530          0.00011560         -0.00008660          0.00013959
       4422.49370000          0.00518926         -0.00141400          0.00039175         -0.00030500          0.00046280
       1681.84780000          0.01595159         -0.00440030          0.00122727         -0.00091310          0.00148861
        663.21490000          0.04720087         -0.01323730          0.00367506         -0.00287280          0.00434089
        267.00585000          0.12619981         -0.03733840          0.01047976         -0.00779880          0.01277688
        108.89592000          0.27982529         -0.09244400          0.02602575         -0.02049300          0.03096216
         44.79731400          0.41030382         -0.17908160          0.05218594         -0.03865600          0.06543104
         18.54031200          0.24188220         -0.16174870          0.04842224         -0.04197400          0.05707014
          7.70709950          0.02071709          0.19399810         -0.06270700          0.06559604         -0.09386140
          3.21437500          0.00443622          0.62785121         -0.27648210          0.19549449         -0.41005510
          1.34401270         -0.00216870          0.34320722         -0.31132840          0.38636227         -0.48607910
          0.56308700          0.00148760         -0.00010200          0.27584791         -0.75348860          1.95041420
          0.23628700         -0.00087720          0.00993085          0.67745539         -0.54814350         -0.29309150
          0.09928110          0.00039698         -0.00418080          0.28560830          0.26985002         -2.30754900
          0.03971240         -0.00010790          0.00119275          0.01675006          0.97010724          1.77847660
  1  1  1 12  4
       1018.41220000          0.00071159         -0.00016880          0.00015264         -0.00022110
        247.39820000          0.00528387         -0.00125010          0.00110387         -0.00137890
         87.79048200          0.02297828         -0.00550960          0.00500340         -0.00741670
         34.24860000          0.08494327         -0.02057220          0.01814153         -0.02236340
         13.87701400          0.22803285         -0.05717830          0.05241729         -0.07944690
          5.73030980          0.39658377         -0.10153640          0.08911554         -0.10183150
          2.39200680          0.36766734         -0.10487000          0.10677427         -0.22045860
          1.00527670          0.10640781          0.05753445         -0.07211440          0.35066535
          0.42439290          0.00281028          0.37524649         -0.60909640          0.97783112
          0.17973060          0.00165268          0.45668244         -0.16157330         -1.12189900
          0.07629100         -0.00040110          0.22572156          0.54191860         -0.50591410
          0.03051640          0.00016315          0.06188888          0.53980064          1.02634120
  1  2  2  5  2
          2.72018530          0.02567866         -0.01281640
          1.07222220          0.12037513          0.17873934
          0.42264050          0.55955359          0.50423470
          0.16659330          0.37100935         -0.11770020
          0.06663730          0.12126366         -0.88859820
# SULFUR      (17s,12p,5d) -> [5s,4p,2d]
S  Roos-ADZ-ANO
  3
  1  0  0 17  5
     346348.23000000          0.00006370         -0.00001760          0.00000516         -0.00000380          0.00000585
      49391.14600000          0.00044935         -0.00012410          0.00003629         -0.00002730          0.00004096
      14610.99000000          0.00147142         -0.00040760          0.00011970         -0.00008760          0.00013668
       5187.20950000          0.00498429         -0.00138200          0.00040336         -0.00030730          0.00045296
       1980.96760000          0.01525241         -0.00427630          0.00125841         -0.00091510          0.00144216
        784.63139000          0.04494424         -0.01281620          0.00374805         -0.00286710          0.00420970
        317.32779000          0.12035338         -0.03610970          0.01069509         -0.00777990          0.01231522
        130.01976000          0.26908335         -0.08987260          0.02665475         -0.02053900          0.03016574
         53.73820800          0.40722490         -0.17728880          0.05454724         -0.03956760          0.06449660
         22.34589600          0.25831856         -0.17312010          0.05462756         -0.04600480          0.06268013
          9.33325120          0.02714669          0.16887115         -0.05692420          0.06098330         -0.08761680
          3.91118680          0.00400872          0.63115534         -0.29658550          0.20575809         -0.39434690
          1.64320660         -0.00192710          0.36103178         -0.32932730          0.40570893         -0.55180690
          0.69174560          0.00134644          0.00184135          0.30470795         -0.81899290          1.99993610
          0.29167360         -0.00081150          0.01069710          0.67383630         -0.44471340         -0.27829840
          0.12314410          0.00036382         -0.00432300          0.27748421          0.18735812         -2.35282500
          0.04925760         -0.00009870          0.00124248          0.01304772          1.00722580          1.79232710
  1  1  1 12  4
       1129.12690000          0.00077145         -0.00019700          0.00018333         -0.00028000
        274.03515000          0.00572945         -0.00146240          0.00130515         -0.00172590
         97.40258400          0.02477182         -0.00640040          0.00600239         -0.00940080
         38.08551800          0.09109122         -0.02387630          0.02129088         -0.02797840
         15.47103300          0.24064577         -0.06532010          0.06221627         -0.10067960
          6.40565900          0.40976882         -0.11476930          0.09978781         -0.11767160
          2.68128280          0.35226804         -0.10657020          0.11944864         -0.25665430
          1.13000500          0.08382797          0.11048130         -0.15959890          0.68243796
          0.47839950          0.00271787          0.41795827         -0.67011450          0.66515564
          0.20318050          0.00078655          0.42517813          0.01331064         -1.44513800
          0.08649230          0.00011535          0.19228231          0.64871747          0.12745221
          0.03459690          0.00003404          0.04207771          0.37095119          0.77294449
  1  2  2  5  2
          3.00536790          0.03293922         -0.03191870
          1.21729760          0.16386221          0.29392107
          0.49305560          0.58677406          0.46210890
          0.19970780          0.31916052         -0.32360540
          0.07988310          0.08508563         -0.75561170
# CHLORINE    (17s,12p,5d) -> [5s,4p,2d]
CL Roos-ADZ-ANO
  3
  1  0  0 17  5
     399432.47000000          0.00006215         -0.00001740          0.00000531         -0.00000470          0.00000595
      56908.83300000          0.00043838         -0.00012290          0.00003739         -0.00003370          0.00004122
      16874.76900000          0.00142781         -0.00040130          0.00012271         -0.00010830          0.00013955
       6010.02780000          0.00481620         -0.00135560          0.00041159         -0.00037410          0.00044686
       2303.28300000          0.01468157         -0.00417440          0.00127960         -0.00112330          0.00146844
        915.65994000          0.04311398         -0.01247260          0.00379416         -0.00346090          0.00411004
        371.72009000          0.11558388         -0.03510470          0.01083171         -0.00951860          0.01251189
        152.89109000          0.26016348         -0.08775020          0.02707379         -0.02486630          0.02954625
         63.43630300          0.40382380         -0.17564250          0.05631797         -0.04964540          0.06763368
         26.48172300          0.27179877         -0.18206990          0.05980454         -0.05901320          0.06396442
         11.10411200          0.03338125          0.14753370         -0.05113350          0.06729192         -0.07622940
          4.67162890          0.00356211          0.63295111         -0.31267210          0.26850578         -0.44555880
          1.97045200         -0.00165600          0.37614178         -0.34374380          0.51536265         -0.53191500
          0.83279460          0.00117962          0.00380802          0.32577967         -1.11610500          2.38922930
          0.35254090         -0.00073110          0.01133746          0.66892575         -0.52914520         -1.29926400
          0.14943410          0.00032425         -0.00444450          0.27170146          0.76655700         -1.50478700
          0.05977360         -0.00008790          0.00129047          0.01386816          0.59696595          1.65737770
  1  1  1 12  4
       1288.97160000          0.00078181         -0.00021070          0.00020575         -0.00031720
        312.24430000          0.00581729         -0.00157040          0.00146090         -0.00194620
        111.34634000          0.02503057         -0.00683040          0.00673436         -0.01067180
         43.73608700          0.09188004         -0.02552010          0.02376316         -0.03157490
         17.85652400          0.24258072         -0.06974890          0.07010553         -0.11574860
          7.43276590          0.41394424         -0.12387560          0.11161894         -0.12908650
          3.12825380          0.34789086         -0.10851620          0.12978530         -0.27649330
          1.32572140          0.07717314          0.13894281         -0.23354130          0.89183689
          0.56441910          0.00312835          0.42954359         -0.67189630          0.41342424
          0.24107410          0.00050049          0.40829131          0.10952051         -1.53837700
          0.10320890          0.00034786          0.18156256          0.66424757          0.46781029
          0.04128360         -0.00002380          0.03396053          0.30179468          0.59904463
  1  2  2  5  2
          3.62045610          0.03682298         -0.04843800
          1.47757170          0.17638808          0.39297464
          0.60302300          0.59139283          0.47951806
          0.24610430          0.30996037         -0.56212450
          0.09844170          0.06672018         -0.56257760
# ARGON       (17s,12p,5d) -> [5s,4p,2d]
AR Roos-ADZ-ANO
  3
  1  0  0 17  5
     455476.77000000          0.00006096         -0.00001730          0.00000544         -0.00000530          0.00000579
      64817.74300000          0.00043020         -0.00012220          0.00003829         -0.00003750          0.00003978
      19256.98700000          0.00139466         -0.00039690          0.00012513         -0.00012020          0.00013641
       6877.00730000          0.00468779         -0.00133670          0.00041795         -0.00041340          0.00042380
       2643.48770000          0.01424066         -0.00409860          0.00129572         -0.00123820          0.00143205
       1054.23750000          0.04169365         -0.01221340          0.00382578         -0.00379760          0.00386068
        429.37122000          0.11183053         -0.03433220          0.01092652         -0.01045540          0.01216691
        177.18859000          0.25298878         -0.08610070          0.02735689         -0.02735260          0.02778303
         73.76394500          0.40044790         -0.17427680          0.05765806         -0.05546770          0.06724781
         30.89700700          0.28245090         -0.18902660          0.06394978         -0.06865230          0.06200867
         12.99948200          0.03906305          0.13009718         -0.04572820          0.07055596         -0.06041520
          5.48767930          0.00314565          0.63399171         -0.32577250          0.30115546         -0.46387010
          2.32257160         -0.00139160          0.38815020         -0.35331040          0.61789886         -0.49311320
          0.98498070          0.00101034          0.00573222          0.33817566         -1.43377400          2.41394970
          0.41839730         -0.00064850          0.01193554          0.66223091         -0.27094710         -1.53597500
          0.17795940          0.00028402         -0.00449410          0.27636906          0.77596409         -1.27729400
          0.07118380         -0.00007710          0.00131952          0.00949692          0.50334371          1.63788950
  1  1  1 12  4
       1462.49620000          0.00078756         -0.00022120          0.00029752         -0.00045430
        354.06731000          0.00586048         -0.00165140          0.00201545         -0.00318150
        126.69779000          0.02510137         -0.00713990          0.00979652         -0.01511580
         49.98909500          0.09200774         -0.02671710          0.03265686         -0.05279920
         20.50929500          0.24317197         -0.07307220          0.10366041         -0.17027200
          8.58046410          0.41674542         -0.13132950          0.14799999         -0.23127500
          3.63010490          0.34542045         -0.10964210          0.20744830         -0.20352810
          1.54652800          0.07305360          0.16048636         -0.50796850          1.74529250
          0.66193690          0.00294397          0.43595556         -0.80424020         -1.39630300
          0.28424280         -0.00023940          0.40458441          0.69669502         -0.47271850
          0.12234630          0.00028995          0.17125106          0.46331690          0.89125570
          0.04893850         -0.00009340          0.01351308          0.04908714          0.06889766
  1  2  2  5  2
          4.32884170          0.04003444         -0.05753400
          1.77423020          0.18334334          0.42320227
          0.72719060          0.59072873          0.45075094
          0.29804820          0.30437283         -0.56963190
          0.11921930          0.06258812         -0.55102580
# POTASSIUM   (17s,12p,4d) -> [6s,5p,3d]
K  Roos-ADZ-ANO
  3
  1  0  0 17  6
     491258.49000000          0.00005842         -0.00002070          0.00000435         -0.00000100          0.00000164         -0.00000890
      73596.26000000          0.00045381         -0.00016070          0.00003401         -0.00000770          0.00001315         -0.00006650
      16749.08500000          0.00237837         -0.00084290          0.00017722         -0.00003950          0.00006615         -0.00036960
       4743.06460000          0.00992078         -0.00353600          0.00075221         -0.00017110          0.00029351         -0.00141650
       1546.57230000          0.03480238         -0.01257040          0.00265519         -0.00058790          0.00097189         -0.00546100
        557.61034000          0.10256352         -0.03848430          0.00837390         -0.00191410          0.00326796         -0.01358480
        216.63552000          0.23961148         -0.09801500          0.02156418         -0.00470680          0.00742939         -0.03639130
         88.97660300          0.38126993         -0.19258520          0.04665380         -0.01073760          0.01770685         -0.03011530
         37.70667000          0.29621852         -0.21748580          0.05565267         -0.01128390          0.01480930         -0.05474160
         14.62274900          0.06375196          0.09256514         -0.02479790          0.00231784          0.00460019          0.06700469
          6.74696650          0.02601417          0.58909472         -0.27722080          0.06582098         -0.11983180         -0.03527940
          3.03462520          0.02795313          0.47571709         -0.33246770          0.05481428         -0.07493820          1.20112230
          0.90298592          0.00130668          0.00807837          0.50767943         -0.07425960          0.09938682         -3.35082100
          0.37318822         -0.00014920         -0.05118210          0.70161851         -0.32299760          0.64446308          2.79270070
          0.06155351          0.00000326         -0.00174370          0.07043030          0.09186196         -1.96324000         -0.43064540
          0.02553669         -0.00000220          0.00060097         -0.05969240          0.93438734          0.95293980         -0.64231060
          0.01021330          0.00000000         -0.00015040          0.00948955          0.06211051          0.61563072          0.70496631
  1  1  1 12  5
       1189.74050000          0.00141380         -0.00033300          0.00006492         -0.00010300          0.00026569
        287.10831000          0.01038087         -0.00249260          0.00048585         -0.00074110          0.00250941
        100.91081000          0.04474237         -0.01076840          0.00209050         -0.00332710          0.00833263
         38.96316500          0.15406934         -0.03906560          0.00755029         -0.01139040          0.04065920
         15.62070400          0.35465661         -0.09285550          0.01777551         -0.02828850          0.06909479
          6.38134000          0.45431722         -0.13401620          0.02546473         -0.03628700          0.17159295
          2.63505000          0.19116706          0.03118623         -0.00496590         -0.00208330         -0.19831070
          1.09542300         -0.01862470          0.40666025         -0.06854900          0.12037081         -0.03116310
          0.45742400         -0.02790530          0.49596210         -0.09481970          0.10952669         -1.38969700
          0.19160900         -0.01460530          0.20243950         -0.07258240          0.41463187          2.67276250
          0.06706320          0.00018929          0.00793367          0.20338465         -1.81305400         -1.75862800
          0.02347210         -0.00028140          0.00119087          0.87327808          1.27013160          0.61694169
  1  2  2  4  3
          0.09333000          0.50545552         -1.13396900          0.97707492
          0.03733200          0.57601816          0.89460794         -1.96236900
          0.01493280          0.02038626          0.42432475          1.88487010
          0.00597300         -0.04888480         -0.14892240         -0.35784830
# CALCIUM     (17s,12p,4d) -> [6s,5p,3d]
CA Roos-ADZ-ANO
  3
  1  0  0 17  6
     542844.56000000          0.00005841         -0.00002110          0.00000685         -0.00000150          0.00000168         -0.00000400
      81324.55700000          0.00045377         -0.00016370          0.00005340         -0.00001170          0.00001293         -0.00002760
      18507.90600000          0.00237823         -0.00085890          0.00027903         -0.00006070          0.00006896         -0.00017260
       5241.13940000          0.00991905         -0.00360190          0.00117888         -0.00025900          0.00028359         -0.00057020
       1708.98930000          0.03479574         -0.01279950          0.00417698         -0.00090720          0.00104107         -0.00274630
        616.18926000          0.10249859         -0.03912940          0.01303884         -0.00288050          0.00311564         -0.00573740
        239.42854000          0.23924588         -0.09936550          0.03357530         -0.00729850          0.00852796         -0.02446030
         98.37458100          0.37922037         -0.19366870          0.07046608         -0.01588600          0.01668291         -0.02371310
         41.71418300          0.29253681         -0.21515880          0.08285525         -0.01799130          0.02303530         -0.09147860
         16.09407900          0.06468846          0.09713469         -0.04133500          0.00742164         -0.01742770          0.16250618
          7.46704860          0.03281779          0.56572226         -0.36805990          0.09616220         -0.08758100         -0.07273020
          3.37858760          0.03199147          0.41996510         -0.38857710          0.09549962         -0.14611870          0.81888116
          1.02991330          0.00254060          0.06391161          0.59698724         -0.18281930          0.32722133         -2.33849000
          0.42260000          0.00098313          0.02369149          0.64234271         -0.41255990          0.36853705          1.93435540
          0.06783130          0.00005600          0.00332540          0.03054920          0.70539294         -2.34379300          0.21528538
          0.02752130         -0.00003000         -0.00222660         -0.01615820          0.47715882          2.24315820         -1.86334000
          0.01100704          0.00000915          0.00073373          0.00502950         -0.01706170         -0.13030730          1.66682650
  1  1  1 12  5
       1402.42710000          0.00127432         -0.00042400          0.00010198         -0.00010830          0.00018813
        338.55939000          0.00936449         -0.00316090          0.00076323         -0.00088700          0.00197915
        119.98925000          0.04001879         -0.01354030          0.00326097         -0.00340270          0.00557656
         46.80993600          0.13890894         -0.04894240          0.01187257         -0.01389780          0.03155397
         18.97619100          0.32858814         -0.11907730          0.02887702         -0.02952650          0.04521323
          7.84183500          0.44618186         -0.17759170          0.04384101         -0.05603990          0.15212192
          3.27635300          0.21822676         -0.00699460         -0.00200520          0.02197499         -0.16059250
          1.37829300          0.01508472          0.41010521         -0.11533190          0.07370106          0.11878904
          0.58247500          0.00741586          0.51830550         -0.17248950          0.35745642         -1.61591100
          0.24694600         -0.00045020          0.18538460         -0.08907560         -0.13208330          2.90021550
          0.08643110          0.00070335          0.00656569          0.69200083         -1.30992600         -2.12745700
          0.03025090         -0.00020640          0.00061610          0.45318416          1.35118460          0.86987929
  1  2  2  4  3
          0.39250000          0.09888404         -0.06448030          1.02905310
          0.15700000          0.35400289         -1.15845300         -0.56109360
          0.06280000          0.60583332          0.93993886         -0.65246380
          0.02512000          0.09979140          0.24451693          0.91827402
# SCANDIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
SC Roos-ADZ-ANO
  4
  1  0  0 21  6
    2715278.00000000          0.00000900         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000
     406598.40000000          0.00007030         -0.00002060          0.00000730         -0.00000180          0.00000260         -0.00000380
      92530.04000000          0.00036940         -0.00010830          0.00003810         -0.00000940          0.00001340         -0.00001890
      26207.92000000          0.00155730         -0.00045720          0.00016110         -0.00003970          0.00005780         -0.00008580
       8549.42900000          0.00563820         -0.00166130          0.00058530         -0.00014420          0.00020370         -0.00028470
       3085.97500000          0.01806450         -0.00537480          0.00189710         -0.00046690          0.00068540         -0.00103110
       1203.17200000          0.05144550         -0.01567320          0.00554030         -0.00136660          0.00191410         -0.00262930
        498.48690000          0.12707080         -0.04083870          0.01453930         -0.00358060          0.00531270         -0.00814650
        216.73600000          0.25490550         -0.09186680          0.03306540         -0.00818040          0.01128470         -0.01500180
         97.87476000          0.36017450         -0.16483380          0.06115120         -0.01512000          0.02309850         -0.03719520
         45.20433000          0.26994140         -0.18091270          0.07020760         -0.01759940          0.02223440         -0.02357950
         20.21187000          0.06163750          0.05165400         -0.02111350          0.00550800          0.00012430         -0.02279820
          9.57475100         -0.00137010          0.50475000         -0.27065280          0.07005320         -0.12218900          0.23648630
          4.54034600          0.00205340          0.50458120         -0.44054920          0.12312720         -0.14779690          0.13085050
          1.99568700         -0.00095410          0.09393700          0.06285390         -0.02804590         -0.03470180          0.23841110
          0.94221500          0.00043550         -0.00297080          0.71691260         -0.24417280          0.64622190         -1.77116600
          0.41784500         -0.00018700          0.00248250          0.44287950         -0.32519970          0.15556920          1.29776820
          0.09576100          0.00009670         -0.00080170          0.02330730          0.35832950         -2.27616700          3.27082980
          0.05135100         -0.00009370          0.00076540         -0.01372210          0.60752200          1.15412310         -6.65044700
          0.02387800          0.00004130         -0.00033710          0.00463010          0.20971750          0.73089930          4.26392470
          0.00955100         -0.00000960          0.00007800         -0.00096690          0.00735930          0.10275990         -0.71246510
  1  1  1 15  5
       4609.88500000          0.00019180         -0.00006450          0.00001890         -0.00002410          0.00003140
       1092.15600000          0.00168010         -0.00056470          0.00016800         -0.00021600          0.00028190
        354.33680000          0.00927530         -0.00314160          0.00092260         -0.00117490          0.00153070
        134.80760000          0.03752900         -0.01284830          0.00383000         -0.00492860          0.00643370
         56.60258000          0.11490240         -0.04053780          0.01193470         -0.01520350          0.01981900
         25.33410000          0.25439250         -0.09287680          0.02796510         -0.03616710          0.04726480
         11.74033000          0.37991660         -0.14765040          0.04354370         -0.05550180          0.07284370
          5.56925900          0.30955560         -0.11280680          0.03528510         -0.04666140          0.06440110
          2.59495800          0.08713980          0.15761620         -0.06168620          0.08722140         -0.11917420
          1.19635100          0.00256100          0.47136960         -0.15801900          0.22269450         -0.38254400
          0.53505900          0.00122680          0.43009950         -0.22299720          0.36197370         -0.39389800
          0.22077600         -0.00047590          0.10180830          0.15843480         -0.88835790          2.19800400
          0.08831000          0.00022640         -0.00184220          0.70244750         -0.40959980         -2.39692000
          0.03532400         -0.00011100          0.00290250          0.28120420          0.91905930          0.89636100
          0.01413000          0.00003470         -0.00078270          0.01348200          0.21314870          0.35148690
  1  2  2 10  4
        110.21970000          0.00082590         -0.00072360          0.00088820         -0.00079750
         32.80041000          0.00668110         -0.00582090          0.00727290         -0.00574830
         12.31300000          0.02815940         -0.02479120          0.03053470         -0.02734940
          5.06381900          0.08372590         -0.07372960          0.09263050         -0.07108940
          2.22554700          0.17840110         -0.15786200          0.19890520         -0.19284550
          0.99234300          0.26729480         -0.22085100          0.26567710         -0.17873910
          0.43636100          0.30373220         -0.20962350          0.09014130         -0.03909720
          0.18570500          0.29501850          0.05386540         -0.65848460          1.37404170
          0.07344100          0.19903620          0.43826460         -0.39701430         -1.98588300
          0.02937600          0.09880500          0.51004480          0.89538510          1.16147000
  1  3  3  6  2
          2.84150000          0.03457760         -0.09573200
          1.12630000          0.09785270         -0.21698380
          0.44640000          0.34953560         -0.57644500
          0.17690000          0.54494830          0.14682810
          0.07010000          0.23054040          0.57506500
          0.02780000          0.03096220          0.20992140
# TITANIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
TI Roos-ADZ-ANO
  4
  1  0  0 21  6
    3014643.00000000          0.00000890         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000
     451432.90000000          0.00006930         -0.00002050          0.00000730         -0.00000180          0.00000260         -0.00000530
     102733.80000000          0.00036440         -0.00010770          0.00003850         -0.00000950          0.00001350         -0.00002630
      29098.17000000          0.00153640         -0.00045480          0.00016260         -0.00004010          0.00005870         -0.00012000
       9492.33000000          0.00556280         -0.00165290          0.00059090         -0.00014580          0.00020570         -0.00039620
       3426.34600000          0.01782860         -0.00534850          0.00191600         -0.00047270          0.00069770         -0.00144350
       1335.89600000          0.05081180         -0.01560890          0.00559920         -0.00138220          0.00193150         -0.00365790
        553.50260000          0.12571800         -0.04072220          0.01471710         -0.00363470          0.00543140         -0.01144970
        240.69250000          0.25299350         -0.09187640          0.03356770         -0.00830710          0.01140250         -0.02093470
        108.72930000          0.35959430         -0.16550280          0.06237530         -0.01548490          0.02391930         -0.05291360
         50.26457000          0.27246950         -0.18360090          0.07240540         -0.01810670          0.02240970         -0.03314180
         22.58004000          0.06359560          0.04772320         -0.01969540          0.00495790          0.00244170         -0.03572990
         10.71432000         -0.00122450          0.50578510         -0.27814850          0.07274550         -0.12994700          0.34737590
          5.09354600          0.00201170          0.50661980         -0.44779230          0.12462260         -0.14412390          0.19621750
          2.24418300         -0.00093570          0.09464750          0.07571830         -0.03012510         -0.04266210          0.21600550
          1.05957000          0.00042050         -0.00280280          0.72182450         -0.25472070          0.68771070         -2.54289500
          0.46884900         -0.00017760          0.00244130          0.43305370         -0.31128130          0.08970370          2.53447060
          0.10614300          0.00008640         -0.00072980          0.02190390          0.39641780         -2.20071600          0.65481180
          0.05526200         -0.00008290          0.00069790         -0.01256510          0.58239440          1.16817660         -3.07838800
          0.02546500          0.00003760         -0.00031470          0.00450140          0.19898060          0.68247570          2.18525880
          0.01018600         -0.00000900          0.00007490         -0.00096630          0.00465100          0.09670200         -0.12137220
  1  1  1 15  5
       5181.15700000          0.00018720         -0.00006430          0.00001780         -0.00002460          0.00003720
       1227.46100000          0.00164140         -0.00056350          0.00015780         -0.00021600          0.00030350
        398.27120000          0.00908300         -0.00314250          0.00086990         -0.00120360          0.00181820
        151.58670000          0.03689510         -0.01290430          0.00362100         -0.00495220          0.00694320
         63.69633000          0.11355990         -0.04095070          0.01136290         -0.01573360          0.02391530
         28.54733000          0.25317900         -0.09460300          0.02679910         -0.03658610          0.05029720
         13.26129000          0.38016760         -0.15139560          0.04214160         -0.05944900          0.09593970
          6.31035200          0.31020000         -0.11414090          0.03368180         -0.04678460          0.05786020
          2.95187500          0.08777410          0.16320570         -0.05898500          0.07944800         -0.08846610
          1.36537000          0.00294910          0.47321730         -0.15122720          0.27628380         -0.65664460
          0.61141500          0.00131940          0.42451320         -0.20347950          0.27142190          0.11031280
          0.25254800         -0.00042150          0.10183770          0.11806170         -0.79246970          1.61485710
          0.10101900          0.00021980         -0.00167870          0.69383950         -0.46317480         -1.74849600
          0.04040800         -0.00010630          0.00283920          0.31458520          0.84321160          0.31630340
          0.01616300          0.00003320         -0.00076640          0.01638690          0.29045090          0.63388040
  1  2  2 10  4
        134.35650000          0.00082950         -0.00066820          0.00107010         -0.00145030
         40.04189000          0.00686720         -0.00549600          0.00903560         -0.01239650
         15.12976000          0.02978290         -0.02413250          0.03925760         -0.05422370
          6.27699000          0.08973600         -0.07293950          0.12440160         -0.17800620
          2.78141000          0.19339830         -0.15795350          0.25010250         -0.33545420
          1.25360200          0.28934680         -0.21643350          0.28000330         -0.18766830
          0.55740500          0.31794410         -0.18224060         -0.08899850          0.78380040
          0.23975900          0.27588610          0.12624550         -0.62602520          0.22363430
          0.09528700          0.15938330          0.44805130         -0.24875410         -1.28760100
          0.03811500          0.07054350          0.48413330          0.81573960          0.96413090
  1  3  3  6  2
          4.24640000          0.03908400         -0.12201770
          1.68310000          0.13383140         -0.36711890
          0.66710000          0.36510790         -0.49912310
          0.26440000          0.49496780          0.25518400
          0.10480000          0.25144470          0.52213820
          0.04150000          0.03832940          0.11207230
# VANADIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
V  Roos-ADZ-ANO
  4
  1  0  0 21  6
    3321857.00000000          0.00000880         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     497435.60000000          0.00006870         -0.00002040          0.00000740         -0.00000170          0.00000330         -0.00000540
     113202.70000000          0.00036100         -0.00010750          0.00003890         -0.00000920          0.00001660         -0.00002720
      32063.33000000          0.00152210         -0.00045390          0.00016420         -0.00003870          0.00007310         -0.00012220
      10459.62000000          0.00551160         -0.00165010          0.00059670         -0.00014080          0.00025210         -0.00041000
       3775.50600000          0.01766850         -0.00534000          0.00193530         -0.00045670          0.00087230         -0.00146550
       1472.04000000          0.05038290         -0.01559340          0.00565820         -0.00133560          0.00235840         -0.00380660
        609.93310000          0.12480880         -0.04072340          0.01489220         -0.00351830          0.00683810         -0.01159340
        265.26340000          0.25172610         -0.09208410          0.03404070         -0.00805470          0.01385690         -0.02209190
        119.86070000          0.35922650         -0.16636470          0.06349340         -0.01508270          0.03069540         -0.05334350
         55.44891000          0.27416450         -0.18580410          0.07421810         -0.01773950          0.02615090         -0.03823630
         24.98372000          0.06486330          0.04585460         -0.01908000          0.00455360          0.00874490         -0.02907220
         11.88056000         -0.00116620          0.50807060         -0.28571740          0.07165820         -0.17680100          0.34559820
          5.66031100          0.00198280          0.50692040         -0.45245900          0.12029780         -0.15916140          0.25792820
          2.49570300         -0.00092240          0.09430990          0.09007790         -0.03297310         -0.08362760          0.02175320
          1.17786600          0.00040990         -0.00270220          0.72508740         -0.24733060          1.01147820         -2.40280600
          0.52004400         -0.00017020          0.00240070          0.42300420         -0.28548310         -0.22802420          2.70767500
          0.11596500          0.00007890         -0.00067900          0.02042980          0.35331150         -2.26950100         -0.25108400
          0.05893800         -0.00007520          0.00064630         -0.01164770          0.59079650          1.60659870         -2.02543500
          0.02694600          0.00003490         -0.00029880          0.00432260          0.22227520          0.30163730          1.79308710
          0.01077800         -0.00000850          0.00007270         -0.00095410          0.00404190          0.13033430         -0.03372380
  1  1  1 15  5
       5777.37700000          0.00018360         -0.00006410          0.00001790         -0.00002930          0.00003760
       1368.67400000          0.00161110         -0.00056260          0.00015830         -0.00025550          0.00031060
        444.12330000          0.00893310         -0.00314410          0.00087600         -0.00143690          0.00184300
        169.09910000          0.03640770         -0.01295560          0.00365290         -0.00589370          0.00715630
         71.10191000          0.11255930         -0.04131800          0.01154370         -0.01897940          0.02447010
         31.90311000          0.25238890         -0.09610600          0.02735360         -0.04405560          0.05280940
         14.85109000          0.38048750         -0.15458390          0.04343200         -0.07318490          0.09891910
          7.08522700          0.31047820         -0.11487580          0.03382940         -0.05429490          0.06201690
          3.32442200          0.08808030          0.16825760         -0.06114900          0.10392680         -0.12794370
          1.54116400          0.00320000          0.47522200         -0.15596350          0.35080200         -0.64800290
          0.69052000          0.00136800          0.41995650         -0.19423340          0.21455920          0.26641430
          0.28542400         -0.00038780          0.10071520          0.12128510         -0.91179100          1.37800780
          0.11417000          0.00021440         -0.00165100          0.68002870         -0.29944180         -1.66822500
          0.04566800         -0.00010280          0.00277480          0.32526770          0.79383860          0.32032510
          0.01826700          0.00003210         -0.00074620          0.01640420          0.24053480          0.68719140
  1  2  2 10  4
        155.85270000          0.00082400         -0.00073700          0.00111480         -0.00160610
         46.49771000          0.00690790         -0.00615680          0.00949820         -0.01385620
         17.62999000          0.03046120         -0.02746690          0.04217370         -0.06229780
          7.35467200          0.09234490         -0.08414480          0.13485540         -0.20931580
          3.27405100          0.19856960         -0.18070830          0.27482530         -0.38597190
          1.48248200          0.29427800         -0.23594040          0.27099700         -0.04116230
          0.66135100          0.31782360         -0.15454830         -0.17801220          0.90020360
          0.28482600          0.27361460          0.19348160         -0.65249560         -0.17294460
          0.11289900          0.15457840          0.46099510         -0.03686490         -1.00120500
          0.04516000          0.05137880          0.41547910          0.73380860          0.90394100
  1  3  3  6  2
          5.90660000          0.04103170         -0.11078580
          2.34120000          0.16050070         -0.38304920
          0.92790000          0.39186680         -0.46986320
          0.36780000          0.46817410          0.29209870
          0.14580000          0.23292270          0.51792180
          0.05780000          0.03878760          0.11509430
# CHROMIUM    (21s,15p,10d,6f) -> [6s,5p,4d,2f]
CR Roos-ADZ-ANO
  4
  1  0  0 21  6
    6177194.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000
     924929.50000000          0.00003520         -0.00001060          0.00000380          0.00000000          0.00000160         -0.00000270
     210486.50000000          0.00018520         -0.00005550          0.00002010         -0.00000480          0.00000920         -0.00001470
      59620.05000000          0.00078170         -0.00023440          0.00008480         -0.00002000          0.00003570         -0.00005850
      19450.76000000          0.00284000         -0.00085460          0.00030980         -0.00007390          0.00014470         -0.00022940
       7022.05600000          0.00919120         -0.00277760          0.00100500         -0.00023660          0.00041230         -0.00068230
       2738.76300000          0.02681960         -0.00823310          0.00299260         -0.00071610          0.00143310         -0.00225550
       1135.81400000          0.07006660         -0.02215430          0.00805280         -0.00189060          0.00319370         -0.00535390
        495.09230000          0.15802290         -0.05364420          0.01974040         -0.00475090          0.00983570         -0.01532300
        224.74870000          0.28468010         -0.11084460          0.04123840         -0.00964650          0.01526100         -0.02636230
        105.38360000          0.34784190         -0.17981180          0.06982360         -0.01712800          0.03887360         -0.05910420
         50.19359000          0.21469600         -0.15326130          0.06194170         -0.01396960          0.01102890         -0.02750750
         22.24957000          0.03639130          0.15704610         -0.07028210          0.01468510          0.01119260          0.00607140
         10.98265000         -0.00233900          0.55798350         -0.35206530          0.09575890         -0.27550750          0.41885790
          5.38366500          0.00157580          0.40642730         -0.38303600          0.09291530         -0.02447570          0.18358050
          2.34368500         -0.00070320          0.05485290          0.26660970         -0.06694350         -0.14028950         -0.34679470
          1.10520200          0.00028400         -0.00183770          0.70724400         -0.30576810          1.39136390         -1.98221100
          0.48784800         -0.00010280          0.00145360          0.31331990         -0.17006770         -0.97588370          2.83069160
          0.08959900          0.00002440         -0.00007650          0.00785530          0.74527870         -1.41883500         -1.93940600
          0.03342300         -0.00001690          0.00023540         -0.00362720          0.39684270          1.71845830          0.89050600
          0.01336900          0.00000600         -0.00004620          0.00107930          0.00528540         -0.15218120          0.33550720
  1  1  1 15  5
       6268.92100000          0.00018740         -0.00006560          0.00002110         -0.00004280          0.00004900
       1485.11800000          0.00164430         -0.00057560          0.00018610         -0.00036790          0.00041520
        481.91460000          0.00912080         -0.00322040          0.00103810         -0.00210200          0.00240430
        183.51420000          0.03719650         -0.01327760          0.00430200         -0.00850300          0.00960040
         77.19005000          0.11492610         -0.04237710          0.01371150         -0.02787310          0.03196840
         34.65178000          0.25692940         -0.09833830          0.03212880         -0.06332420          0.07142640
         16.14846000          0.38335940         -0.15697670          0.05144400         -0.10828590          0.12916330
          7.71093900          0.30473540         -0.10861110          0.03596730         -0.07062480          0.10060060
          3.60715400          0.08243440          0.18485070         -0.07642230          0.17670900         -0.34212040
          1.66736200          0.00273620          0.47596480         -0.19422200          0.57084960         -0.83549890
          0.73908800          0.00145720          0.40672300         -0.18560820         -0.03570800          1.41643780
          0.30132600         -0.00032910          0.10212740          0.20105820         -1.25601300         -0.04974320
          0.12053000          0.00022830         -0.00155650          0.68652460          0.40458460         -1.33599800
          0.04821200         -0.00010210          0.00275350          0.26067750          0.58709910          0.97815560
          0.01928500          0.00003220         -0.00077330          0.00171750          0.00688970          0.25778320
  1  2  2 10  4
        150.83410000          0.00118076         -0.00073170          0.00147090         -0.00198190
         44.99723000          0.00966118         -0.00593860          0.01221630         -0.01633860
         16.96088000          0.04140729         -0.02588100          0.05281196         -0.07298360
          7.04015400          0.12131664         -0.07615180          0.16199100         -0.23037030
          3.10387800          0.24095388         -0.15059490          0.29357778         -0.36806240
          1.37589600          0.32484954         -0.16871590          0.23847460          0.09367552
          0.59228200          0.32060330         -0.07194640         -0.23308910          0.77748431
          0.24213800          0.23605297          0.19912700         -0.56415040         -0.16503670
          0.09128400          0.09618844          0.30980514         -0.18723120         -0.99837170
          0.03651400          0.02433110          0.61183718          0.71568988          0.83634879
  1  3  3  6  2
          7.71390000          0.03904982         -0.09216890
          3.05750000          0.16805148         -0.36090680
          1.21190000          0.40501469         -0.45590560
          0.48030000          0.45078646          0.24749491
          0.19040000          0.22761472          0.51827288
          0.07550000          0.05358525          0.19289890
# MANGANESE   (21s,15p,10d,6f) -> [6s,5p,4d,2f]
MN Roos-ADZ-ANO
  4
  1  0  0 21  6
    3960805.00000000          0.00000870         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     593115.50000000          0.00006800         -0.00002050          0.00000750         -0.00000180          0.00000280         -0.00000580
     134976.80000000          0.00035740         -0.00010780          0.00003960         -0.00000940          0.00001420         -0.00002880
      38230.67000000          0.00150710         -0.00045530          0.00016750         -0.00003980          0.00006220         -0.00012990
      12471.54000000          0.00545760         -0.00165520          0.00060840         -0.00014450          0.00021660         -0.00043510
       4501.74300000          0.01749970         -0.00535760          0.00197440         -0.00046990          0.00074070         -0.00155900
       1755.21200000          0.04993510         -0.01565660          0.00577530         -0.00137120          0.00203370         -0.00404210
        727.30390000          0.12388070         -0.04095100          0.01523350         -0.00363220          0.00580330         -0.01236980
        316.36780000          0.25049690         -0.09287230          0.03492020         -0.00830490          0.01207350         -0.02356150
        143.00980000          0.35895920         -0.16842450          0.06548770         -0.01572940          0.02604550         -0.05741360
         66.21805000          0.27590170         -0.18918780          0.07702400         -0.01842520          0.02385160         -0.04110840
         29.91896000          0.06596040          0.04616510         -0.01954550          0.00436730          0.00485290         -0.03230330
         14.30318000         -0.00123720          0.51471840         -0.30058260          0.07696050         -0.14730130          0.37768110
          6.83945100          0.00195630          0.50418490         -0.45625350          0.12103880         -0.14594950          0.26094310
          3.01237400         -0.00090710          0.09186060          0.12027270         -0.03966160         -0.03547160         -0.00501200
          1.41880800          0.00039750         -0.00258700          0.72812930         -0.26313840          0.77851700         -2.43265200
          0.62362400         -0.00015930          0.00230800          0.40324530         -0.26294560         -0.08070840          2.70448470
          0.13409800          0.00006830         -0.00059920          0.01779610          0.43299070         -2.04653000         -0.18863590
          0.06554800         -0.00006470          0.00056840         -0.01018190          0.54643390          1.23053960         -1.98447500
          0.02958400          0.00003130         -0.00027370          0.00400370          0.19067480          0.54467080          1.81069230
          0.01183400         -0.00000790          0.00006890         -0.00092400         -0.00022150          0.08868420         -0.15215100
  1  1  1 15  5
       7048.27100000          0.00017840         -0.00006390          0.00001760         -0.00003520          0.00003830
       1669.67800000          0.00156680         -0.00056100          0.00015600         -0.00030590          0.00032350
        541.85710000          0.00871540         -0.00314650          0.00086970         -0.00173610          0.00188620
        206.42950000          0.03571610         -0.01303980          0.00363280         -0.00712210          0.00752970
         86.89334000          0.11121530         -0.04192160          0.01162420         -0.02325950          0.02535640
         39.06309000          0.25160510         -0.09857340          0.02770210         -0.05418060          0.05694880
         18.24725000          0.38123080         -0.15962520          0.04470710         -0.09199500          0.10353020
          8.74128900          0.31029020         -0.11507290          0.03304800         -0.06717710          0.07872650
          4.11933200          0.08812070          0.17705150         -0.06260660          0.13777230         -0.19226940
          1.91480400          0.00359900          0.47737790         -0.16108730          0.46888220         -0.69137230
          0.85789300          0.00145210          0.41264500         -0.17690520          0.10208170          0.61487770
          0.35495000         -0.00033420          0.09948660          0.12091270         -1.04596100          0.92077360
          0.14198000          0.00020600         -0.00159780          0.64429190         -0.06945110         -1.51537700
          0.05679200         -0.00009730          0.00267830          0.35827300          0.68819970          0.36824920
          0.02271700          0.00003030         -0.00071550          0.01972490          0.18214330          0.70160790
  1  2  2 10  4
        199.83570000          0.00086890         -0.00061410          0.00124530         -0.00144350
         59.72176000          0.00740550         -0.00517230          0.01084020         -0.01243060
         22.74772000          0.03343540         -0.02375470          0.04918380         -0.05807330
          9.56500300          0.10222310         -0.07263280          0.16008170         -0.19535270
          4.28549900          0.21763820         -0.15840410          0.32014190         -0.37455660
          1.95097500          0.31388650         -0.20224890          0.26650740          0.04875240
          0.87279600          0.32265140         -0.12237590         -0.28152510          0.78022240
          0.37562100          0.24897740          0.19545300         -0.57570980         -0.11241070
          0.14800900          0.11555480          0.39788320         -0.07034260         -1.10424800
          0.05920400          0.03978050          0.51436970          0.67373320          0.97098940
  1  3  3  6  2
          9.54130000          0.03498520         -0.08024420
          3.78180000          0.15976610         -0.34830930
          1.49900000          0.39648690         -0.47839020
          0.59410000          0.45515610          0.22560180
          0.23550000          0.23977600          0.52997080
          0.09330000          0.05663870          0.19214410
# IRON        (21s,15p,10d,6f) -> [6s,5p,4d,2f]
FE Roos-ADZ-ANO
  4
  1  0  0 21  6
    4316265.00000000          0.00000870         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000
     646342.40000000          0.00006760         -0.00002020          0.00000660         -0.00000180          0.00000270         -0.00000570
     147089.70000000          0.00035510         -0.00010650          0.00003470         -0.00000940          0.00001400         -0.00002870
      41661.52000000          0.00149760         -0.00044950          0.00014670         -0.00003970          0.00006110         -0.00012810
      13590.77000000          0.00542370         -0.00163470          0.00053290         -0.00014380          0.00021330         -0.00043330
       4905.75000000          0.01739500         -0.00529340          0.00173040         -0.00046800          0.00072770         -0.00153520
       1912.74600000          0.04966290         -0.01548620          0.00506480         -0.00136580          0.00200470         -0.00403960
        792.60430000          0.12335570         -0.04059850          0.01338920         -0.00362260          0.00570610         -0.01216330
        344.80650000          0.25002290         -0.09250400          0.03080250         -0.00829640          0.01195170         -0.02374360
        155.89990000          0.35990370         -0.16905000          0.05821830         -0.01577060          0.02569760         -0.05631410
         72.23091000          0.27899280         -0.19228400          0.06938660         -0.01858720          0.02403850         -0.04348580
         32.72506000          0.06684860          0.04532080         -0.01668270          0.00410360          0.00461020         -0.02746690
         15.66762000         -0.00530450          0.52919120         -0.28071900          0.07759400         -0.14507200          0.35854230
          7.50348300         -0.00219420          0.52613700         -0.43502950          0.12054490         -0.14701850          0.29723730
          3.31222300         -0.00156720          0.08634040          0.13102650         -0.04091310         -0.02284040         -0.05560670
          1.55847100          0.00070060         -0.03666660          0.72871520         -0.26246710          0.74958120         -2.35786300
          0.68391400         -0.00001330         -0.01644200          0.39852760         -0.25768170         -0.07729630          2.62219710
          0.14675700          0.00007580         -0.00138020          0.01733970          0.43339760         -1.92800900         -0.09696180
          0.07058300         -0.00006820          0.00098670         -0.00966160          0.54662560          1.06569450         -1.99104900
          0.03144900          0.00003290         -0.00043850          0.00385200          0.18747110          0.60856320          1.72090500
          0.01258000         -0.00000840          0.00010900         -0.00090970          0.00270480          0.09196060         -0.10051950
  1  1  1 15  5
       7721.48900000          0.00017940         -0.00005530          0.00001830         -0.00003460          0.00003990
       1829.12600000          0.00157650         -0.00048580          0.00016140         -0.00030210          0.00034850
        593.62800000          0.00878210         -0.00273220          0.00090230         -0.00170710          0.00197160
        226.20540000          0.03607770         -0.01136920          0.00377270         -0.00706390          0.00815410
         95.26145000          0.11272930         -0.03684800          0.01213510         -0.02300820          0.02661730
         42.85920000          0.25609280         -0.08750780          0.02898860         -0.05424340          0.06262640
         20.04971000          0.38909430         -0.14330720          0.04708140         -0.09111680          0.10665340
          9.62088500          0.31513030         -0.09976090          0.03395630         -0.06773050          0.09339330
          4.54137100          0.07892750          0.18578570         -0.06721070          0.14812740         -0.23558910
          2.11350000         -0.01959520          0.47909010         -0.17287650          0.46037010         -0.68343630
          0.94720100         -0.01837930          0.40815100         -0.16620750          0.03915710          0.63114560
          0.39124300         -0.00505370          0.09750330          0.14589740         -0.91332880          0.89696110
          0.15649700          0.00027940         -0.00155180          0.61178550         -0.15696580         -1.38206000
          0.06259900         -0.00022310          0.00263140          0.35925890          0.64005450          0.16944950
          0.02504000          0.00006380         -0.00070260          0.04073560          0.28359880          0.76562060
  1  2  2 10  4
        217.36880000          0.00090860         -0.00072370          0.00125890         -0.00161930
         64.99976000          0.00775700         -0.00612900          0.01092110         -0.01394030
         24.77314000          0.03509610         -0.02813160          0.04980140         -0.06542380
         10.43614000          0.10690640         -0.08623050          0.16077490         -0.22105340
          4.67965300          0.22354780         -0.18379140          0.32346140         -0.41836770
          2.12562200          0.31482280         -0.22300410          0.24231990          0.18487330
          0.94524200          0.31706310         -0.09948400         -0.34487070          0.78688110
          0.40268500          0.24533970          0.24250460         -0.54964040         -0.34311580
          0.15665100          0.11980180          0.42175960          0.03680090         -0.87041820
          0.06266000          0.04248370          0.43580570          0.65109530          0.90154760
  1  3  3  6  2
         11.27490000          0.03258760         -0.07378730
          4.46900000          0.15612850         -0.35717230
          1.77130000          0.40094740         -0.48333090
          0.70210000          0.45321070          0.23975430
          0.27830000          0.23899830          0.52100980
          0.11030000          0.05966160          0.18732480
# COBALT      (21s,15p,10d,6f) -> [6s,5p,4d,2f]
CO Roos-ADZ-ANO
  4
  1  0  0 21  6
    4676708.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     700317.20000000          0.00006700         -0.00002040          0.00000760         -0.00000170          0.00000350         -0.00000550
     159373.00000000          0.00035240         -0.00010750          0.00004000         -0.00000890          0.00001770         -0.00002790
      45140.67000000          0.00148620         -0.00045380          0.00016920         -0.00003790          0.00007790         -0.00012220
      14725.75000000          0.00538250         -0.00165000          0.00061480         -0.00013730          0.00026890         -0.00042470
       5315.44800000          0.01726470         -0.00534190          0.00199590         -0.00044680          0.00093000         -0.00145680
       2072.49800000          0.04930400         -0.01562390          0.00584290         -0.00130530          0.00252090         -0.00399180
        858.82310000          0.12253550         -0.04092880          0.01543990         -0.00346240          0.00732690         -0.01146260
        373.64370000          0.24860380         -0.09312740          0.03551540         -0.00794870          0.01498120         -0.02386790
        168.96820000          0.35837910         -0.16965500          0.06696130         -0.01512480          0.03342110         -0.05222480
         78.31971000          0.27841060         -0.19245090          0.07961680         -0.01794030          0.02931210         -0.04836930
         35.53724000          0.06785880          0.04347140         -0.01872100          0.00395780          0.00996530         -0.01193170
         17.04735000         -0.00115750          0.51737040         -0.31042280          0.07479190         -0.19610040          0.30946350
          8.17553400          0.00192300          0.50464650         -0.46054150          0.11490080         -0.17626490          0.39054300
          3.61157800         -0.00088960          0.09201290          0.13587240         -0.04223380         -0.03861910         -0.28532140
          1.69746800          0.00038520         -0.00234550          0.73020260         -0.24686420          1.08415130         -2.05903400
          0.74363600         -0.00015140          0.00224230          0.39330010         -0.24198820         -0.42626710          2.57812780
          0.15832500          0.00006130         -0.00053850          0.01679520          0.37226090         -1.91956200         -0.61815020
          0.07500900         -0.00005670          0.00050120         -0.00930160          0.56759560          1.37322520         -1.30766700
          0.03309300          0.00002780         -0.00024560          0.00375190          0.21737940          0.27764580          1.32262520
          0.01323700         -0.00000730          0.00006420         -0.00090600          0.00352470          0.13569010          0.10033550
  1  1  1 15  5
       8421.84200000          0.00017490         -0.00006400          0.00001880         -0.00003830          0.00003990
       1995.00000000          0.00153770         -0.00056240          0.00016620         -0.00033620          0.00035810
        647.48550000          0.00857460         -0.00316260          0.00093160         -0.00189450          0.00197280
        246.77950000          0.03528970         -0.01316530          0.00389910         -0.00789320          0.00841770
        103.96890000          0.11048560         -0.04258770          0.01259830         -0.02567960          0.02674400
         46.81052000          0.25156270         -0.10095360          0.03016540         -0.06112280          0.06551270
         21.92703000          0.38208840         -0.16409550          0.04922890         -0.10201960          0.10577100
         10.53715000          0.30945670         -0.11461140          0.03475150         -0.07728850          0.10794080
          4.98067800          0.08757280          0.18585070         -0.07188090          0.18257780         -0.29257760
          2.31982400          0.00382660          0.48071240         -0.18284560          0.51785750         -0.65412750
          1.03960900          0.00151230          0.40513110         -0.15347360         -0.05554230          0.76754230
          0.42892100         -0.00028530          0.09651020          0.15599370         -0.93997170          0.67550470
          0.17156800          0.00020140         -0.00155780          0.59752060         -0.05577780         -1.32197400
          0.06862700         -0.00009280          0.00261270          0.36419420          0.61553970          0.22022440
          0.02745100          0.00002890         -0.00069720          0.04018450          0.23599690          0.76020010
  1  2  2 10  4
        237.59280000          0.00092700         -0.00084720          0.00120630         -0.00171410
         71.08881000          0.00793870         -0.00721600          0.01046470         -0.01490830
         27.11903000          0.03606410         -0.03323240          0.04802990         -0.06950530
         11.44826000          0.10968160         -0.10231590          0.15456280         -0.23750360
          5.13954200          0.22645780         -0.21395030          0.31068290         -0.45108020
          2.33269400          0.31367760         -0.24295660          0.20905210          0.26005330
          1.03403000          0.31243550         -0.06620310         -0.35934790          0.80108240
          0.43789900          0.24628330          0.29378190         -0.51288440         -0.47137080
          0.16896300          0.12633170          0.41673020          0.07429740         -0.71721040
          0.06758500          0.03900340          0.37130920          0.68550190          0.82498910
  1  3  3  6  2
         12.84030000          0.03236910         -0.07453890
          5.08940000          0.15788750         -0.37667740
          2.01720000          0.41073330         -0.47481310
          0.79960000          0.45170690          0.27648130
          0.31690000          0.22855470          0.50315310
          0.12560000          0.05597530          0.17676000
# NICKEL      (21s,15p,10d,6f) -> [6s,5p,4d,2f]
NI Roos-ADZ-ANO
  4
  1  0  0 21  6
    5048010.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     755918.10000000          0.00006680         -0.00002040          0.00000770         -0.00000170          0.00000360         -0.00000560
     172026.20000000          0.00035100         -0.00010760          0.00004030         -0.00000890          0.00001810         -0.00002900
      48724.57000000          0.00148020         -0.00045410          0.00017020         -0.00003750          0.00007960         -0.00012620
      15894.89000000          0.00536130         -0.00165120          0.00061850         -0.00013620          0.00027480         -0.00044210
       5737.46800000          0.01719850         -0.00534630          0.00200800         -0.00044320          0.00094960         -0.00150170
       2237.05100000          0.04912750         -0.01564110          0.00587970         -0.00129480          0.00257820         -0.00416600
        927.03020000          0.12216700         -0.04099880          0.01554880         -0.00343810          0.00748690         -0.01179840
        403.34610000          0.24810880         -0.09339290          0.03580900         -0.00790000          0.01536150         -0.02506610
        182.42820000          0.35826230         -0.17040030          0.06764850         -0.01506930          0.03423590         -0.05358670
         84.58917000          0.27910230         -0.19374000          0.08065480         -0.01791070          0.03032360         -0.05236170
         38.42293000          0.06830140          0.04354050         -0.01892620          0.00392190          0.00992020         -0.00783680
         18.46879000         -0.00118350          0.51950270         -0.31545840          0.07504680         -0.20137340          0.31051000
          8.86819000          0.00191620          0.50372390         -0.46110780          0.11324250         -0.18303880          0.44043500
          3.91887000         -0.00088450          0.09139080          0.14489870         -0.04393570         -0.02175280         -0.39622500
          1.83985300          0.00038170         -0.00227360          0.73044870         -0.24438380          1.09749980         -2.00536500
          0.80466300         -0.00014830          0.00220820          0.38778550         -0.23485420         -0.46797710          2.63047080
          0.16984600          0.00005850         -0.00051330          0.01622800          0.36865540         -1.85498200         -0.80559900
          0.07937000         -0.00005370          0.00047480         -0.00891480          0.57243370          1.32221160         -1.12092700
          0.03470000          0.00002660         -0.00023480          0.00364400          0.21592430          0.29731170          1.36863090
          0.01388000         -0.00000710          0.00006240         -0.00089650          0.00028770          0.11571620         -0.01542830
  1  1  1 15  5
       9148.79600000          0.00017360         -0.00006400          0.00001960         -0.00004290          0.00004470
       2167.17100000          0.00152660         -0.00056290          0.00017310         -0.00037840          0.00042100
        703.38570000          0.00852130         -0.00316920          0.00097220         -0.00212800          0.00221460
        268.13420000          0.03513410         -0.01321830          0.00407440         -0.00891460          0.00994010
        113.00780000          0.11025030         -0.04287100          0.01321020         -0.02898040          0.03007480
         50.91339000          0.25168060         -0.10196740          0.03171290         -0.06949990          0.07851530
         23.87740000          0.38250460         -0.16592570          0.05192370         -0.11563460          0.11657620
         11.48924000          0.30893670         -0.11411670          0.03605130         -0.09018240          0.15823130
          5.43688400          0.08722900          0.18968800         -0.07725320          0.22442350         -0.46936450
          2.53383700          0.00392060          0.48171720         -0.19414970          0.59429600         -0.66531670
          1.13530900          0.00153920          0.40202030         -0.14772330         -0.16225690          1.24799050
          0.46789100         -0.00026550          0.09551930          0.17187530         -1.03404300          0.06088250
          0.18715600          0.00019940         -0.00154890          0.60426630          0.15003200         -1.22401600
          0.07486200         -0.00009090          0.00258830          0.35544100          0.61273400          0.59511470
          0.02994500          0.00002840         -0.00069060          0.02125060          0.09486060          0.50804730
  1  2  2 10  4
        258.86670000          0.00095250         -0.00092610          0.00123660         -0.00177870
         77.49604000          0.00817990         -0.00792440          0.01074820         -0.01571750
         29.58972000          0.03730820         -0.03662670          0.04958940         -0.07273200
         12.51527000          0.11328720         -0.11305370          0.15987740         -0.25411760
          5.62446800          0.23147570         -0.23263250          0.31923220         -0.46309120
          2.55130300          0.31613600         -0.24935030          0.17919010          0.36602760
          1.12806000          0.31084320         -0.03532690         -0.41307200          0.75610370
          0.47537300          0.24210240          0.32694740         -0.47494000         -0.60471820
          0.18212800          0.12298390          0.41969840          0.17118430         -0.55810490
          0.07285100          0.03516760          0.31817540          0.63979400          0.78181900
  1  3  3  6  2
         14.21560000          0.03449540         -0.07796490
          5.63450000          0.16793190         -0.39359110
          2.23330000          0.42354040         -0.45649420
          0.88520000          0.44325990          0.31147600
          0.35090000          0.21579090          0.49201070
          0.13910000          0.05136220          0.16482550
# COPPER      (21s,15p,10d,6f) -> [6s,5p,4d,2f]
CU Roos-ADZ-ANO
  4
  1  0  0 21  6
    9148883.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000
    1369956.00000000          0.00003470         -0.00001070          0.00000400          0.00000000          0.00000170         -0.00000290
     311782.60000000          0.00018240         -0.00005610          0.00002100         -0.00000450          0.00000940         -0.00001540
      88318.80000000          0.00077000         -0.00023700          0.00008860         -0.00001870          0.00003650         -0.00006340
      28815.53000000          0.00279760         -0.00086380          0.00032360         -0.00006950          0.00014820         -0.00023880
      10403.46000000          0.00905600         -0.00280830          0.00105020         -0.00022030          0.00042260         -0.00074630
       4057.79100000          0.02644080         -0.00832980          0.00312940         -0.00067530          0.00147000         -0.00232870
       1682.97400000          0.06918040         -0.02245400          0.00843860         -0.00176120          0.00328320         -0.00594890
        733.75430000          0.15647990         -0.05456570          0.02077020         -0.00452220          0.01014890         -0.01569050
        333.26770000          0.28318800         -0.11339210          0.04369710         -0.00904300          0.01588480         -0.03044290
        156.43380000          0.34834740         -0.18512600          0.07460190         -0.01670180          0.04068720         -0.05907700
         74.69721000          0.21729720         -0.15873810          0.06696040         -0.01288420          0.01192630         -0.04167230
         33.32262000          0.03723950          0.16600910         -0.07944260          0.01333560          0.01022030          0.03684610
         16.62237000         -0.00258070          0.56808840         -0.38487520          0.09790590         -0.29168770          0.38295340
          8.20826000          0.00156040          0.39505050         -0.37246620          0.07249740         -0.02332030          0.36386430
          3.60940000         -0.00067990          0.05193440          0.31938580         -0.06056550         -0.06553060         -0.83790950
          1.68344900          0.00026190         -0.00105780          0.70435860         -0.29718440          1.32294460         -1.33277500
          0.73375700         -0.00008680          0.00123940          0.27996240         -0.10637610         -1.05594100          2.35852380
          0.11020700          0.00001770         -0.00011970          0.00579100          0.79532710         -1.23087800         -1.82846500
          0.03878600         -0.00001290          0.00008860         -0.00266520          0.30758250          1.65313940          1.20324560
          0.01551400          0.00000490         -0.00003400          0.00095220          0.01483550         -0.20155160          0.04477910
  1  1  1 15  5
       9713.25300000          0.00017840         -0.00006580          0.00002260         -0.00004700          0.00004950
       2300.88900000          0.00156860         -0.00057820          0.00019820         -0.00041560          0.00048660
        746.77060000          0.00875430         -0.00325660          0.00112040         -0.00232770          0.00245540
        284.68060000          0.03608110         -0.01357800          0.00466570         -0.00979250          0.01150310
        119.99990000          0.11299150         -0.04399850          0.01521570         -0.03165890          0.03321540
         54.07386000          0.25664090         -0.10418090          0.03608110         -0.07599310          0.09109850
         25.37321000          0.38518750         -0.16768020          0.05925500         -0.12447490          0.12482900
         12.20962000          0.30288080         -0.10714430          0.03709930         -0.09551570          0.19632250
          5.75742100          0.08164480          0.20500460         -0.09339450          0.27896170         -0.67869170
          2.67340200          0.00338810          0.48293960         -0.22900240          0.62767590         -0.49863740
          1.18683500          0.00157700          0.39022330         -0.12323690         -0.32615190          1.47981130
          0.48159300         -0.00022080          0.09437740          0.23118240         -1.00099000         -0.46342030
          0.19263700          0.00021200         -0.00154480          0.60241090          0.33267140         -0.93055400
          0.07705500         -0.00008950          0.00264390          0.30652420          0.54404040          0.69217010
          0.03082200          0.00002840         -0.00072740          0.01307760          0.05542390          0.36845720
  1  2  2 10  4
        249.34970000          0.00126400         -0.00155310          0.00186920         -0.00233540
         74.63837000          0.01063890         -0.01311300          0.01612510         -0.02290710
         28.37641000          0.04720950         -0.05895500          0.07240920         -0.09394700
         11.94893000          0.13793660         -0.17782060          0.23628630         -0.37675940
          5.31764600          0.26266750         -0.32716810          0.38296120         -0.32713530
          2.36441700          0.33241630         -0.24099740         -0.16793750          0.95009690
          1.01238600          0.30779900          0.18960650         -0.68246030         -0.04648790
          0.40677300          0.21664100          0.50340450          0.08869930         -0.88560220
          0.14733100          0.08407720          0.30703590          0.60278640          0.54282850
          0.05893200          0.00504380          0.03253970          0.14438100          0.32722400
  1  3  3  6  2
         15.43330000          0.03901820         -0.08437670
          6.11720000          0.18754340         -0.41437330
          2.42460000          0.44621250         -0.41723570
          0.96100000          0.42647410          0.35876800
          0.38090000          0.19155910          0.47774570
          0.15100000          0.04165180          0.15423760
# ZINC        (21s,15p,10d,6f) -> [6s,5p,4d,2f]
ZN Roos-ADZ-ANO
  4
  1  0  0 21  6
    5820021.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000
     871523.40000000          0.00006650         -0.00002050          0.00000780         -0.00000170          0.00000270         -0.00000590
     198335.00000000          0.00034950         -0.00010800          0.00004080         -0.00000910          0.00001370         -0.00003010
      56176.31000000          0.00147380         -0.00045590          0.00017230         -0.00003860          0.00005980         -0.00013300
      18325.82000000          0.00533830         -0.00165780          0.00062590         -0.00013990          0.00020950         -0.00045660
       6614.95500000          0.01712710         -0.00536850          0.00203290         -0.00045590          0.00071120         -0.00158960
       2579.19900000          0.04894090         -0.01571240          0.00595460         -0.00133090          0.00197450         -0.00428140
       1068.84900000          0.12179340         -0.04122570          0.01576690         -0.00354270          0.00559090         -0.01258460
        465.10450000          0.24765890         -0.09406410          0.03637540         -0.00814300          0.01189240         -0.02556620
        210.41300000          0.35824320         -0.17199640          0.06892730         -0.01561320          0.02539150         -0.05827530
         97.61629000          0.27981700         -0.19585000          0.08237330         -0.01853580          0.02475170         -0.05034830
         44.38020000          0.06857580          0.04532440         -0.02009310          0.00413200          0.00312860         -0.02002860
         21.42308000         -0.00131270          0.52445220         -0.32530080          0.07898840         -0.14558310          0.36143710
         10.30891000          0.00191630          0.50060100         -0.46020860          0.11413160         -0.14872710          0.36964340
          4.55364500         -0.00087910          0.08947690          0.16339080         -0.04867670          0.03235680         -0.27535280
          2.13282100          0.00037780         -0.00217430          0.72999360         -0.25153870          0.66517080         -2.09870600
          0.92969700         -0.00014330          0.00213750          0.37667470         -0.23375600         -0.09666510          2.46453010
          0.19214700          0.00005410         -0.00046910          0.01508170          0.43801720         -1.65751300         -0.10951070
          0.08759500         -0.00004910          0.00043030         -0.00822400          0.55217390          0.75108880         -1.76128800
          0.03770200          0.00002470         -0.00021650          0.00344840          0.16985730          0.73491840          1.53073600
          0.01508100         -0.00000670          0.00005910         -0.00087620          0.00249730          0.07323190         -0.07747830
  1  1  1 15  5
      10684.58000000          0.00017140         -0.00006410          0.00001680         -0.00003600          0.00004200
       2530.90300000          0.00150870         -0.00056380          0.00014820         -0.00031830          0.00037880
        821.48200000          0.00843680         -0.00318040          0.00083380         -0.00178740          0.00208760
        313.25220000          0.03489610         -0.01331030          0.00350650         -0.00753410          0.00897610
        132.10940000          0.10993590         -0.04336340          0.01141350         -0.02449690          0.02862580
         59.58751000          0.25205640         -0.10373190          0.02756400         -0.05930450          0.07089200
         28.00399000          0.38327840         -0.16900020          0.04514620         -0.09830750          0.11494810
         13.50425000          0.30782600         -0.11286720          0.03039090         -0.07579650          0.11746310
          6.40188100          0.08651150          0.19638980         -0.06646510          0.18815810         -0.33659140
          2.98576900          0.00408220          0.48297950         -0.16153150          0.46903910         -0.64064250
          1.33690200          0.00158570          0.39676170         -0.13642790         -0.03999370          0.74529540
          0.54996100         -0.00023230          0.09411040          0.11657870         -0.81822090          0.70157210
          0.21998400          0.00019580         -0.00153060          0.54683600         -0.22067370         -1.15028400
          0.08799400         -0.00008780          0.00254790          0.41490790          0.53820720         -0.05687820
          0.03519800          0.00002740         -0.00067970          0.07954380          0.36284880          0.84283010
  1  2  2 10  4
        305.01150000          0.00102500         -0.00138600          0.00152390         -0.00179460
         91.40003000          0.00884670         -0.01201630          0.01363620         -0.01752960
         34.95829000          0.04068310         -0.05596400          0.06257500         -0.07605900
         14.83697000          0.12323990         -0.17605410          0.21698560         -0.30775460
          6.68074800          0.24793300         -0.34913890          0.40159130         -0.40478260
          3.02902600          0.33086680         -0.27309330         -0.16958970          0.86315710
          1.33483900          0.31736350          0.21104720         -0.70399180          0.12409940
          0.55860800          0.22301480          0.51804310          0.13084190         -0.93622630
          0.21174300          0.08092210          0.26108130          0.59401250          0.39627950
          0.08469700          0.00354320          0.02024490          0.18018630          0.51834500
  1  3  3  6  2
         16.57440000          0.04557150         -0.09412220
          6.56950000          0.21536030         -0.43664550
          2.60390000          0.46964770         -0.37405330
          1.03210000          0.40406900          0.42861550
          0.40910000          0.16303650          0.47241450
          0.16210000          0.02361610          0.09871230
# BASIS="Roos Augmented Triple Zeta ANO"
#Elements                             References
#--------                             ----------
#H - Ne:  P.O. Widmark, P.A. Malmqvist, B. Roos, Theor. Chim. Acta, 77,
#         291 (1990).
#Na - Ar: P.O. Widmark, B. J. Persson and B. Roos Theor. Chim. Acta, 79,
#         419 (1991).
#Sc - Zn: R. Pou-Amerigo, M. Merchan, I. Nebot-Gil, P.O. Widmark and B. Roos,
#         Theor. Chim. Acta, 92, 149 (1995).
#
# HYDROGEN    (8s,4p,3d) -> [4s,3p,2d]
H  Roos-ATZ-ANO
  3
  1  0  0  8  4
        188.61445000          0.00096390         -0.00131190          0.00242240         -0.01157010
         28.27659600          0.00749200         -0.01034510          0.02033820         -0.08371540
          6.42483000          0.03759540         -0.05049530          0.08963940         -0.44516630
          1.81504100          0.14339500         -0.20738550          0.44229070         -1.14627100
          0.59106300          0.34863630         -0.43508850          0.57571440          2.50318710
          0.21214900          0.43829740         -0.02472970         -0.98028900         -1.58284930
          0.07989100          0.16510660          0.32252600         -0.67215380          0.03096569
          0.02796200          0.02102290          0.70727540          1.14176850          0.30862864
  1  1  1  4  3
          2.30500000          0.11279020         -0.21086880          0.75995010
          0.80675000          0.41850750         -0.59437960          0.16461590
          0.28236200          0.47000770          0.08968890         -1.37101400
          0.09882700          0.18262600          0.86116340          1.05931550
  1  2  2  3  2
          1.81900000          0.27051340         -0.79380350
          0.72760000          0.55101250         -0.09142520
          0.29104000          0.33108660          0.86200330
# HELIUM      (9s,4p,3d) -> [4s,3p,2d]
HE Roos-ATZ-ANO
  3
  1  0  0  9  4
       1149.27050000          0.00035774         -0.00053060          0.00070544         -0.00047220
        172.04457000          0.00277289         -0.00403300          0.00705199         -0.01047220
         39.08046500          0.01429838         -0.02258040          0.03126037         -0.01940990
         11.03617300          0.05586749         -0.10262550          0.32197965         -0.71273560
          3.56415200          0.16336284         -0.45771141          1.00474880         -0.01013290
          1.24044300          0.33133146         -0.60596530         -1.29080400          1.93433390
          0.44731600          0.41429728          0.57131336         -0.47258960         -2.54165900
          0.16420600          0.18903228          0.54758341          0.95308829          0.89814050
          0.05747200          0.00515606          0.01165900          0.05061692          0.54395940
  1  1  1  4  3
          4.55000000          0.08926060         -0.18673500          0.85489228
          1.59250000          0.38050238         -0.51173450          0.10926707
          0.55737500          0.44912372         -0.19815060         -1.26381200
          0.19508100          0.27765440          0.99587976          0.90243325
  1  2  2  3  2
          3.40000000          0.28055213         -0.95147161
          1.36000000          0.56558317          0.18505878
          0.54400000          0.30332967          0.69874000
# LITHIUM     (14s,9p,4d,3f) -> [5s,4p,3d,2f]
LI Roos-ATZ-ANO
  4
  1  0  0 14  5
       9497.93440000          0.00007470         -0.00001100          0.00000640         -0.00004010          0.00015530
       1416.81120000          0.00058360         -0.00008570          0.00004890         -0.00031020          0.00121290
        321.45994000          0.00306100         -0.00045070          0.00026580         -0.00164650          0.00634650
         91.12416300          0.01260110         -0.00186300          0.00106850         -0.00663950          0.02593170
         29.99989100          0.04234720         -0.00635750          0.00397710         -0.02266020          0.08532950
         11.01763100          0.11475800         -0.01776730          0.01120300         -0.05824470          0.21962470
          4.37280100          0.23936590         -0.03979680          0.03121890         -0.12226070          0.40388970
          1.83125600          0.35759180         -0.07012820          0.06165080         -0.13524710          0.36488270
          0.80226100          0.30337580         -0.10294690          0.15065020         -0.05426510         -0.55096830
          0.36264800          0.08637930         -0.09370780          0.18747830          0.08320130         -1.38761000
          0.11399500          0.00264390          0.22012880         -1.09410700          1.74793500          1.98390880
          0.05123700          0.00121700          0.59337740         -0.29242230         -1.64630700         -0.75902980
          0.02246800          0.00056200          0.29452750          0.84809440         -0.74085420         -0.68444260
          0.00786000          0.00001970          0.02495030          0.44800090          1.30386500          0.64145200
  1  1  1  9  4
         13.11950400          0.00144900         -0.00232680          0.00948250         -0.01053320
          3.07742420          0.00799580         -0.01122420          0.06320780         -0.07342820
          1.09880050          0.02134850         -0.03446260          0.17514660         -0.24101740
          0.43577840          0.05011950         -0.03387750          0.57689390         -0.88596330
          0.18024320          0.19547390         -0.45445200          0.55635160          1.62517800
          0.07613330          0.41911190         -0.49630840         -1.29108200         -0.33356840
          0.03254650          0.34816470          0.48858790          0.20705210         -1.25048500
          0.01401820          0.15059750          0.56023390          0.42867280          0.94681210
          0.00490640          0.01570330          0.07028070          0.00433120          0.20398210
  1  2  2  4  3
          0.45000000          0.02237290         -0.03046180          0.17667930
          0.15750000          0.37508790         -0.57345880          0.99447180
          0.05512500          0.46891730         -0.27418710         -1.55262100
          0.01929380          0.36536290          0.95628830          0.87869010
  1  3  3  3  2
          0.24000000          0.38777830         -0.37956520
          0.09600000          0.40160980         -0.61030860
          0.03840000          0.44614990          1.09006880
# BERYLLIUM   (14s,9p,4d,3f) -> [5s,4p,3d,2f]
BE Roos-ATZ-ANO
  4
  1  0  0 14  5
      22628.59900000          0.00005330         -0.00001020          0.00001240         -0.00001630          0.00002030
       3372.31810000          0.00041810         -0.00008040          0.00009760         -0.00010870          0.00013930
        760.35040000          0.00222600         -0.00042810          0.00051670         -0.00072720          0.00089930
        211.74048000          0.00956280         -0.00184870          0.00225260         -0.00232140          0.00303920
         67.22346800          0.03481790         -0.00680080          0.00822820         -0.01240240          0.01555530
         23.37217700          0.10594610         -0.02137190          0.02644130         -0.02509110          0.03697740
          8.72137300          0.24566320         -0.05303520          0.06578970         -0.11646220          0.15845460
          3.46809100          0.38607360         -0.10045770          0.13010640         -0.06311670          0.08359830
          1.45214400          0.31037320         -0.13751390          0.19754920         -0.67003370          0.95775190
          0.60861500          0.06389400         -0.06507040          0.07492650          1.22635800         -3.52772300
          0.25768600         -0.00153140          0.32457320         -1.38872200          1.07468780          3.75338910
          0.10417600          0.00118250          0.61816430          0.15458290         -2.96245500         -1.19402400
          0.04242700         -0.00025210          0.20476750          1.02601810          1.56000350         -1.24778000
          0.01484900          0.00007380          0.00430350          0.02577770          0.28184410          1.35910940
  1  1  1  9  4
         33.71018400          0.00103780         -0.00121420          0.00258730         -0.00228730
          8.05764950          0.00660870         -0.00561260          0.02089540         -0.05162490
          2.83647140          0.02155900         -0.02547970          0.05737160         -0.02179070
          1.09996570          0.06087780         -0.01144150          0.26426850         -1.01121800
          0.44339640          0.20355730         -0.51385070          1.06476000          0.73527740
          0.18222640          0.45796690         -0.49080920         -1.43630700          0.91566940
          0.07572410          0.36859060          0.72214520         -0.05473260         -1.93169500
          0.03168540          0.06306410          0.43076220          0.77703460          1.16330190
          0.01108990          0.00210970          0.00225560         -0.03205040          0.20468350
  1  2  2  4  3
          1.40000000          0.00667730         -0.01038680          0.18372870
          0.49000000          0.24681340          0.89258070          0.84247000
          0.17150000          0.65744630         -0.15070990         -1.49449700
          0.06002500          0.25351910         -0.68121650          1.11748040
  1  3  3  3  2
          0.50000000          0.32812970         -1.10394400
          0.20000000          0.65980420          0.65022980
          0.08000000          0.16284720          0.35201450
# BORON       (14s,9p,4d,3f) -> [5s,4p,3d,2f]
B  Roos-ATZ-ANO
  4
  1  0  0 14  5
      33360.21700000          0.00005830         -0.00001210          0.00001210         -0.00001800          0.00002150
       4972.09520000          0.00045650         -0.00009500          0.00009450         -0.00012920          0.00013760
       1125.64170000          0.00240890         -0.00050280          0.00049970         -0.00077710          0.00096490
        316.49136000          0.01016310         -0.00212640          0.00211920         -0.00278200          0.00280310
        102.00726000          0.03609550         -0.00767440          0.00765190         -0.01256000          0.01654500
         36.29587300          0.10598100         -0.02321790          0.02340450         -0.03012700          0.03061560
         13.97141000          0.23956540         -0.05694680          0.05811560         -0.11132910          0.16803220
          5.74115600          0.37377260         -0.10625770          0.11167390         -0.10474970          0.02641520
          2.49426800          0.30814650         -0.14576940          0.17056230         -0.45988410          0.82053220
          1.11420200          0.07769280         -0.04302850          0.01726760          0.67401790         -2.15453300
          0.42154900          0.00147970          0.37194410         -0.99890440          1.50425190          1.02175820
          0.16963300          0.00049910          0.56520900         -0.22657220         -2.47604300          1.70610160
          0.06853500         -0.00002620          0.19212690          1.02945500          0.57766700         -3.08376400
          0.02398700          0.00002360          0.02191280          0.22137860          0.74299930          1.80833780
  1  1  1  9  4
         55.00000000          0.00101860         -0.00077760          0.00075900         -0.00322100
         13.36610100          0.00739580         -0.00577680          0.00591510         -0.03257940
          4.13539400          0.03225140         -0.02261340          0.01360090         -0.13130910
          1.48125600          0.09834640         -0.06968340          0.03206280         -0.68095730
          0.60213600          0.23180240         -0.25511460          0.62952610         -0.34919830
          0.25563600          0.34124360         -0.36077860          0.17326490          1.39374620
          0.11115100          0.29329830          0.06123950         -0.89178530         -0.35297960
          0.04764800          0.16959510          0.29599380         -0.35355500         -0.77473540
          0.01667700          0.15075690          0.66292780          0.84690410          0.57687380
  1  2  2  4  3
          1.20000000          0.08034580         -0.12246280          0.51304620
          0.42000000          0.42193580         -0.56047330          0.50979380
          0.14700000          0.46391670         -0.08942600         -1.31899900
          0.05145000          0.28557340          0.90159380          0.86638550
  1  3  3  3  2
          0.85000000          0.18252190         -0.47733130
          0.34000000          0.39464530         -0.65781140
          0.13600000          0.61043750          0.95136720
# CARBON      (14s,9p,4d,3f) -> [5s,4p,3d,2f]
C  Roos-ATZ-ANO
  4
  1  0  0 14  5
      50557.50100000          0.00005530         -0.00001200          0.00001190         -0.00001560          0.00001740
       7524.78560000          0.00043430         -0.00009400          0.00009270         -0.00011400          0.00012320
       1694.32760000          0.00231590         -0.00050280          0.00049890         -0.00067310          0.00076340
        472.82279000          0.00987290         -0.00214760          0.00211800         -0.00253230          0.00270030
        151.71075000          0.03521950         -0.00779420          0.00777840         -0.01090030          0.01267800
         53.91874600          0.10419380         -0.02376340          0.02363280         -0.02778070          0.03028660
         20.65931100          0.24127410         -0.06002350          0.06163060         -0.09587130          0.12014640
          8.38397600          0.38401740         -0.11539850          0.11896800         -0.12478060          0.12427730
          3.57701500          0.30823710         -0.15390090          0.18806210         -0.39324600          0.55304310
          1.54711800          0.06830550         -0.01459460         -0.05403040          0.67960040         -1.66049700
          0.61301300          0.00077820          0.38958490         -0.98141370          1.19786900          0.21977070
          0.24606800          0.00099050          0.53972910         -0.10967580         -1.89795200          2.65683290
          0.09908700         -0.00008930          0.18840600          0.88473560         -0.00446140         -3.59655600
          0.03468000          0.00004710          0.02585750          0.29649830          1.01421480          1.85211290
  1  1  1  9  4
         83.33315500          0.00122410         -0.00114440          0.00146690         -0.00372130
         19.55761100          0.00943890         -0.00897960          0.01445530         -0.03798440
          6.08036500          0.04177440         -0.03784560          0.04663730         -0.16980420
          2.17931700          0.13183300         -0.12927080          0.23665370         -0.81141520
          0.86515000          0.27891190         -0.37840220          0.60887340          0.24217300
          0.36194400          0.36686630         -0.26921370         -0.39177930          1.30306730
          0.15474000          0.27905910          0.29175420         -0.87002290         -1.20014200
          0.06542900          0.13804810          0.54366980          0.42005050         -0.09054520
          0.02290000          0.03419500          0.26283080          0.57994970          0.56980090
  1  2  2  4  3
          1.90000000          0.09873120         -0.14550130          0.56376830
          0.66500000          0.45296610         -0.50768090          0.43125920
          0.23275000          0.43624570         -0.10156300         -1.27799800
          0.08146300          0.27192500          0.92519220          0.83542050
  1  3  3  3  2
          1.25000000          0.31136500         -0.50413800
          0.50000000          0.51596730         -0.43737190
          0.20000000          0.37742310          1.01472460
# NITROGEN    (14s,9p,4d,3f) -> [5s,4p,3d,2f]
N  Roos-ATZ-ANO
  4
  1  0  0 14  5
      74761.71500000          0.00005020         -0.00001120          0.00000970         -0.00001210          0.00001870
      11123.65400000          0.00039460         -0.00008780          0.00007650         -0.00009030          0.00012930
       2512.68570000          0.00208850         -0.00046670          0.00040480         -0.00051790          0.00082180
        703.77729000          0.00890790         -0.00199310          0.00173980         -0.00200460          0.00277580
        225.47879000          0.03208840         -0.00730330          0.00634560         -0.00836000          0.01376940
         79.61581000          0.09744740         -0.02282590          0.02014050         -0.02274400          0.03116420
         30.23728300          0.23178950         -0.05922070          0.05240310         -0.07448660          0.13563680
         12.26362200          0.37769110         -0.11561210          0.10665170         -0.11086000          0.13557620
          5.26508600          0.31879170         -0.15650830          0.15833880         -0.29833890          0.66633410
          2.33347100          0.08237820         -0.02310580         -0.00500510          0.32128220         -1.62494200
          0.90185600          0.00279050          0.37564760         -0.84187200          1.17102980         -0.38598650
          0.35833600          0.00024650          0.54576530         -0.15905630         -0.86495620          3.23066540
          0.14109300         -0.00002890          0.21035430          0.59120260         -1.22379300         -3.51745000
          0.04938300          0.00000970          0.01278950          0.57660530          1.44458050          1.52006560
  1  1  1  9  4
        126.66657000          0.00114230         -0.00095650          0.00142010         -0.00270580
         29.83738900          0.00895910         -0.00757630          0.01254390         -0.03026210
          9.39403800          0.04053750         -0.03369470          0.05099130         -0.11909920
          3.40510400          0.12949010         -0.11334370          0.20571180         -0.62785490
          1.35000000          0.27678080         -0.30554980          0.54520410         -0.21161480
          0.55769600          0.36888890         -0.27339530         -0.15225420          1.40746300
          0.23244900          0.29346190          0.20192520         -0.83771660         -0.66666490
          0.09426400          0.12846830          0.49253440          0.04965950         -0.68070720
          0.03299200          0.03905860          0.40980120          0.74594410          0.74984860
  1  2  2  4  3
          2.75000000          0.12053068         -0.17333210          0.61298904
          0.96250000          0.50760685         -0.47399030          0.31696608
          0.33687500          0.44539556          0.03678810         -1.21666300
          0.11790600          0.15876917          0.89316126          0.87035573
  1  3  3  3  2
          1.80000000          0.33068755         -0.76707010
          0.72000000          0.55560706         -0.01115110
          0.28800000          0.30748869          0.80193318
# OXYGEN      (14s,9p,4d,3f) -> [5s,4p,3d,2f]
O  Roos-ATZ-ANO
  4
  1  0  0 14  5
     105374.95000000          0.00004590         -0.00001050          0.00000900         -0.00001090          0.00001810
      15679.24000000          0.00036070         -0.00008250          0.00007050         -0.00008220          0.00012130
       3534.54470000          0.00191980         -0.00044120          0.00037570         -0.00046750          0.00080930
        987.36516000          0.00820670         -0.00188640          0.00161460         -0.00184650          0.00257700
        315.97875000          0.02972570         -0.00695400          0.00593400         -0.00755850          0.01377940
        111.65428000          0.09045580         -0.02172080          0.01878660         -0.02108680          0.02811120
         42.69945100          0.21740540         -0.05685130          0.04946830         -0.06675110          0.13747540
         17.39559600          0.36876570         -0.11396350          0.10303990         -0.10936730          0.12206900
          7.43830900          0.33727980         -0.16202010          0.16205860         -0.27314310          0.73734930
          3.22286200          0.09675050         -0.03338000          0.00093670          0.20971370         -1.70575100
          1.25387700          0.00256740          0.36550680         -0.82242510          1.20348070         -0.35040600
          0.49515500          0.00137460          0.55200310         -0.10179020         -0.67746940          3.14299460
          0.19166500         -0.00014100          0.22363930          0.42539390         -1.42988400         -3.34748100
          0.06708300          0.00006830          0.00657450          0.68770280          1.48910680          1.40123750
  1  1  1  9  4
        200.00000000          0.00089330         -0.00083840          0.00126180         -0.00195280
         46.53336700          0.00736900         -0.00684910          0.01116280         -0.02434040
         14.62180900          0.03493920         -0.03285050          0.05183160         -0.09447540
          5.31306400          0.11529850         -0.11000600          0.19788450         -0.54898560
          2.10252500          0.25832310         -0.31352630          0.57076520         -0.34954760
          0.85022300          0.36962310         -0.31960110         -0.17892910          1.46590890
          0.33759700          0.32387890          0.22172430         -0.89820770         -0.75718940
          0.12889200          0.14679890          0.56226160          0.26666430         -0.59056730
          0.04511200          0.03361270          0.30132510          0.62589940          0.79593210
  1  2  2  4  3
          3.75000000          0.12849340         -0.21820550          0.62420930
          1.31250000          0.52118840         -0.48176950          0.24030630
          0.45937500          0.43457840          0.13575950         -1.18364200
          0.16078100          0.14574090          0.82977340          0.92087220
  1  3  3  3  2
          2.35000000          0.36341110         -0.88354060
          0.94000000          0.56215550          0.22624080
          0.37600000          0.26352790          0.67223250
# FLUORINE    (14s,9p,4d,3f) -> [5s,4p,3d,2f]
F  Roos-ATZ-ANO
  4
  1  0  0 14  5
     103109.46000000          0.00006370         -0.00001480          0.00001510         -0.00001540          0.00002450
      15281.00700000          0.00050280         -0.00011720          0.00011870         -0.00011600          0.00016930
       3441.53920000          0.00266770         -0.00062390          0.00063630         -0.00065960          0.00108910
        967.09483000          0.01120030         -0.00262800          0.00265990         -0.00255000          0.00356210
        314.03534000          0.03909800         -0.00935030          0.00960680         -0.01023610          0.01777030
        113.44230000          0.11226570         -0.02784900          0.02843360         -0.02676290          0.03582820
         44.64472700          0.24720420         -0.06768800          0.07198310         -0.08293450          0.16274940
         18.94287400          0.36803450         -0.12305420          0.13103930         -0.11416490          0.12263700
          8.53274300          0.29086170         -0.15221800          0.20316170         -0.31608660          0.80374170
          3.91940100          0.07810240         -0.00757940         -0.09159900          0.44872390         -2.23161400
          1.56815700          0.00354030          0.37593130         -1.00702500          1.16053510          0.63328330
          0.62329000          0.00091570          0.54384820          0.01746270         -1.36957000          2.29000020
          0.24086100          0.00007650          0.21277460          0.74900270         -0.60414010         -3.12315900
          0.08430100          0.00002050          0.00664220          0.34476920          1.29671020          1.53811960
  1  1  1  9  4
        245.33029000          0.00098800         -0.00097930          0.00140030         -0.00214470
         56.91900500          0.00829110         -0.00834100          0.01356230         -0.02797690
         17.60456800          0.04073900         -0.04074570          0.06060520         -0.11268560
          6.27499500          0.13533040         -0.14552660          0.26782200         -0.68476350
          2.44703000          0.28096370         -0.35562750          0.58183690          0.02453600
          0.99506000          0.35883510         -0.25371630         -0.42803960          1.38243700
          0.40397300          0.30381120          0.28087000         -0.79915710         -1.14451700
          0.15481000          0.13893790          0.56520350          0.46852140         -0.20204710
          0.05418400          0.02581860          0.23237080          0.48624410          0.68548720
  1  2  2  4  3
          5.00000000          0.13035590         -0.28336550          0.64835310
          1.75000000          0.52550550         -0.53295890          0.08528130
          0.61250000          0.44216400          0.33934740         -1.07624500
          0.21437500          0.12327470          0.67721890          1.00032870
  1  3  3  3  2
          3.20000000          0.35649820         -0.89941610
          1.28000000          0.58411540          0.26248020
          0.51200000          0.24042220          0.65173540
# NEON        (14s,9p,4d,3f) -> [5s,4p,3d,2f]
NE Roos-ATZ-ANO
  4
  1  0  0 14  5
     166165.08000000          0.00004720         -0.00001110          0.00001380         -0.00001340          0.00001870
      23107.52400000          0.00040070         -0.00009420          0.00011550         -0.00010150          0.00013780
       5060.15390000          0.00219320         -0.00051800          0.00064920         -0.00065470          0.00092610
       1384.61230000          0.00958760         -0.00226650          0.00276320         -0.00232050          0.00310600
        436.51258000          0.03507340         -0.00845930          0.01073360         -0.01138250          0.01639810
        153.47148000          0.10465170         -0.02604860          0.03183250         -0.02534250          0.03407520
         59.38908700          0.23771230         -0.06535970          0.08719600         -0.10583830          0.16092110
         24.86196700          0.36960610         -0.12226570          0.15298110         -0.09837220          0.13776010
         11.01570400          0.30616090         -0.15857100          0.28479790         -0.52302700          0.88474080
          4.96517500          0.08419850         -0.00602870         -0.19295490          1.12262340         -2.83224200
          1.93650300          0.00370350          0.38289570         -1.32258800          0.49014010          2.19101090
          0.76572800          0.00096540          0.53886490          0.49012790         -1.73790500          0.44521020
          0.29553800          0.00005400          0.21144870          0.75461750          0.39778720         -2.20758300
          0.10343800          0.00002680          0.00280490          0.06136710          0.89004130          1.52725550
  1  1  1  9  4
        234.94500000          0.00158260         -0.00221020          0.00339890         -0.00759070
         55.07738500          0.01257670         -0.01851140          0.03630470         -0.04185460
         17.38954900          0.05698650         -0.08152120          0.14392890         -0.43275860
          6.38953700          0.16812300         -0.29235700          0.73364640         -0.77251740
          2.54208200          0.30738600         -0.54030600         -0.10766930          2.10381540
          1.03376400          0.35831120          0.09151550         -1.21431500         -1.59728600
          0.41878800          0.27869380          0.60908800          0.64108330         -0.00261610
          0.16462700          0.09521110          0.24352740          0.35686170          0.63860640
          0.05761900          0.00210200          0.00713030          0.01895010         -0.00225460
  1  2  2  4  3
          6.42000000          0.13708560         -0.42047260          0.74155800
          2.24700000          0.54471000         -0.55929570         -0.34783030
          0.78645000          0.44972740          0.70000990         -0.65982570
          0.27525750          0.06537090          0.33900230          1.02106730
  1  3  3  3  2
          4.19000000          0.34597040         -0.93628700
          1.67600000          0.61486820          0.33666420
          0.67040000          0.20832290          0.60353970
# SODIUM      (17s,12p,5d,4f) -> [6s,5p,3d,2f]
NA Roos-ATZ-ANO
  4
  1  0  0 17  6
     138773.72000000          0.00007636         -0.00001870          0.00000255         -0.00000230          0.00000364         -0.00000170
      20325.89900000          0.00052939         -0.00012910          0.00001760         -0.00001600          0.00002582         -0.00001000
       5878.60490000          0.00183722         -0.00045110          0.00006160         -0.00005530          0.00008615         -0.00004890
       2015.43730000          0.00653431         -0.00159820          0.00021769         -0.00019860          0.00032753         -0.00012770
        739.62658000          0.02092231         -0.00521350          0.00071184         -0.00063400          0.00100249         -0.00077750
        280.82116000          0.06426610         -0.01627270          0.00221369         -0.00199710          0.00347727         -0.00272200
        108.71501000          0.17089923         -0.04645830          0.00632867         -0.00546590          0.00977528         -0.01681110
         42.60157200          0.35610342         -0.11144450          0.01509121         -0.01276240          0.02880208         -0.07091840
         16.82981700          0.40213461         -0.18537340          0.02530901         -0.01876960          0.05266945         -0.23941720
          6.68644860          0.12746393         -0.06005440          0.00808949         -0.00747550          0.02852077         -0.06083470
          2.66748770          0.00061064          0.35924086         -0.05305070          0.03897469         -0.18124290          0.78439608
          1.06746210          0.00338457          0.57207971         -0.11164110          0.08327536         -0.14683560          0.84719710
          0.42818910         -0.00132870          0.22321420         -0.13831340          0.20560497         -0.33984270         -2.03625300
          0.17208010          0.00085748         -0.00502860         -0.02990100         -0.04683150          0.65955083         -0.24226820
          0.06925880         -0.00047610          0.00595957          0.44900485         -0.79823140          1.85913770          2.35803770
          0.02790920          0.00022186         -0.00253770          0.47484493         -0.57595290         -3.55761200         -2.25578000
          0.01116330         -0.00006380          0.00078635          0.22905052          1.44086540          1.88655310          0.90445966
  1  1  1 12  5
        383.79172000          0.00102867         -0.00011860          0.00015162         -0.00018580          0.00002038
         94.39807200          0.00743093         -0.00086340          0.00110681         -0.00115460         -0.00049790
         32.36150700          0.03273646         -0.00379970          0.00487773         -0.00606080          0.00196514
         12.05435200          0.11687036         -0.01384260          0.01792042         -0.01828510         -0.00087320
          4.64171860          0.27753763         -0.03315040          0.04350073         -0.05598100          0.05166830
          1.81728760          0.39800015         -0.04899740          0.06554272         -0.05672000         -0.01024290
          0.71827120          0.32331086         -0.04658270          0.07245938         -0.15067210          0.47624183
          0.28558030          0.09433492         -0.03024570          0.09073829         -0.00335500         -0.88974630
          0.11399470          0.00109373          0.22294313         -0.76763740          1.54882680         -0.26055090
          0.04562920          0.00178158          0.50923252         -0.39771490         -1.89946400          1.90119440
          0.01830100         -0.00069800          0.37196823          0.92303779          0.39892154         -2.63448100
          0.00732040          0.00022539          0.04475107          0.17065606          0.64929030          1.68088220
  1  2  2  5  3
          0.86260360          0.02177426         -0.01348600          0.02840092
          0.34514180         -0.00721860         -0.00299870         -0.20618900
          0.13809690          0.33517471         -0.46667530         -1.21588300
          0.05525480          0.36379749         -0.62374900          1.83133530
          0.02210190          0.49254995          1.10909490         -0.92087030
  1  3  3  4  2
          0.32814490          0.01063271         -0.03833350
          0.15734730         -0.49599110         -0.30098330
          0.07544890         -0.26287320         -0.64602910
          0.03017960         -0.47485960          1.12421000
# MAGNESIUM   (17s,12p,5d,4f) -> [6s,5p,3d,2f]
MG Roos-ATZ-ANO
  4
  1  0  0 17  6
     169973.87000000          0.00007417         -0.00001880          0.00000379         -0.00000440          0.00000684         -0.00000710
      24699.06600000          0.00051736         -0.00013060          0.00002638         -0.00003080          0.00004631         -0.00004210
       7175.48510000          0.00177276         -0.00045010          0.00009109         -0.00010460          0.00016849         -0.00019220
       2478.79200000          0.00623864         -0.00157940          0.00031906         -0.00037490          0.00054725         -0.00044000
        917.73259000          0.01976587         -0.00509070          0.00103163         -0.00118030          0.00193137         -0.00229800
        351.75140000          0.06017463         -0.01575210          0.00318903         -0.00375480          0.00545737         -0.00428070
        137.51557000          0.16016295         -0.04484030          0.00913931         -0.01046200          0.01729461         -0.02100840
         54.43028600          0.33917581         -0.10853870          0.02227591         -0.02638960          0.03812473         -0.02842980
         21.72256900          0.40883352         -0.18759800          0.03965557         -0.04506790          0.07914147         -0.10871400
          8.71944840          0.15183413         -0.08683860          0.01868253         -0.02557030          0.01594961          0.06640619
          3.51471660          0.00195927          0.33464216         -0.08001640          0.10765675         -0.13968240         -0.01738970
          1.42121320          0.00418518          0.59813818         -0.18827570          0.21164824         -0.53435960          1.14513150
          0.57607650         -0.00187660          0.23180428         -0.21162620          0.43129749         -0.28133200         -1.77632600
          0.23395250          0.00120338         -0.00693860          0.14066560         -0.96823710          3.08684680         -0.12364070
          0.09515600         -0.00067450          0.00680179          0.68477064         -0.97343960         -3.53760100          3.00224390
          0.03875100          0.00031460         -0.00280300          0.34545022          1.46805860          1.02585020         -4.22933300
          0.01550040         -0.00008880          0.00083003          0.00874972          0.09800990          0.56587909          2.41537470
  1  1  1 12  5
        557.13078000          0.00079833         -0.00016120          0.00013230         -0.00021600          0.00031544
        135.48388000          0.00589231         -0.00119310          0.00094881         -0.00048420          0.00072367
         47.21295800          0.02583591         -0.00524640          0.00431193         -0.00750940          0.01089367
         18.00095500          0.09406296         -0.01931180          0.01513244         -0.00373040          0.00243732
          7.11466070          0.24134480         -0.05049450          0.04187188         -0.07988840          0.12540044
          2.86302400          0.38746464         -0.08296280          0.06595574          0.01126479          0.01067632
          1.16401850          0.35595067         -0.08827490          0.09294055         -0.56057880          1.09323020
          0.47630470          0.12288168         -0.03970790          0.05017503          0.66659154         -3.22292200
          0.19573560          0.00380787          0.42165449         -0.75622220          1.23752910          3.64862140
          0.08067830          0.00230283          0.58978450         -0.18127870         -2.36745000         -2.39119800
          0.03332660         -0.00085890          0.10380275          1.03897020          1.29736030          0.71760597
          0.01333060          0.00027579          0.00502440          0.09524704          0.07151495          0.17597721
  1  2  2  5  3
          1.04456440          0.01605667         -0.04289690          0.20912538
          0.48574730          0.02264646          0.18907793         -0.90436520
          0.22588410          0.46449386          0.77129122         -0.29454590
          0.10504150          0.47219231         -0.32119970          1.57346520
          0.04201660          0.16336646         -0.76069020         -1.16827500
  1  3  3  4  2
          0.49952380          0.00588707         -0.30407460
          0.28386680         -0.51196050         -1.11399300
          0.16131440         -0.46978720          1.10670980
          0.06452580         -0.11745110          0.30597008
# ALUMINUM    (17s,12p,5d,4f) -> [6s,5p,3d,2f]
AL Roos-ATZ-ANO
  4
  1  0  0 17  6
     208459.49000000          0.00007078         -0.00001840          0.00000432         -0.00000430          0.00000648         -0.00000780
      29971.59800000          0.00049759         -0.00012920          0.00003029         -0.00003050          0.00004502         -0.00004730
       8764.45650000          0.00167444         -0.00043710          0.00010265         -0.00010220          0.00015532         -0.00021000
       3060.70730000          0.00580246         -0.00151200          0.00035421         -0.00035890          0.00052217         -0.00047560
       1147.49630000          0.01811648         -0.00479430          0.00112743         -0.00111920          0.00171468         -0.00243970
        445.75595000          0.05440537         -0.01462910          0.00343446         -0.00348670          0.00506469         -0.00446160
        176.70642000          0.14492054         -0.04143990          0.00980341         -0.00974050          0.01501684         -0.02177380
         70.94362000          0.31321200         -0.10118870          0.02408671         -0.02459030          0.03577722         -0.03013250
         28.72400000          0.41334250         -0.18447700          0.04527494         -0.04498180          0.07132737         -0.11759120
         11.69892300          0.19059653         -0.12273700          0.03095121         -0.03404100          0.04282415          0.04163135
          4.78536970          0.00707487          0.27348316         -0.07575180          0.08910950         -0.13355890         -0.03258050
          1.96375180          0.00484032          0.61530733         -0.22480450          0.22809994         -0.44484980          1.22705040
          0.80785940         -0.00233010          0.28146024         -0.25485420          0.38525013         -0.52149340         -1.45069000
          0.33299060          0.00153518         -0.00503600          0.20149503         -0.80088860          2.94805910         -1.20188000
          0.13746930         -0.00086880          0.00796206          0.68310534         -0.99962600         -2.57699600          4.27550510
          0.05682380          0.00040223         -0.00353640          0.30782923          1.19801100         -0.19367300         -4.77835900
          0.02272950         -0.00011120          0.00100247          0.02408008          0.36451428          1.10610360          2.32923960
  1  1  1 12  5
        677.76458000          0.00079717         -0.00013730          0.00015515         -0.00016860          0.00036347
        164.83442000          0.00589941         -0.00101230          0.00113147         -0.00108570          0.00162437
         57.68342400          0.02586307         -0.00449520          0.00508163         -0.00558830          0.01256209
         22.10867400          0.09471373         -0.01657140          0.01841598         -0.01713210          0.02439129
          8.78775140          0.24484796         -0.04414490          0.05014804         -0.05622460          0.13515491
          3.55708740          0.39837993         -0.07248030          0.08138367         -0.07224890          0.06998835
          1.45487800          0.35294610         -0.07465500          0.09799899         -0.16960580          0.56219989
          0.59893630          0.10280005          0.01880214         -0.01844020          0.10547020         -1.54752200
          0.24763730          0.00234580          0.27739515         -0.62774810          1.09587210          0.33806270
          0.10269950          0.00175805          0.44207475         -0.24598520         -0.80230420          1.69032720
          0.04268530         -0.00053410          0.29055057          0.35129892         -0.92384590         -2.21506500
          0.01707410          0.00019528          0.16625332          0.65543563          1.16081480          1.10120160
  1  2  2  5  3
          1.26731440          0.01856849         -0.00676530          0.15132202
          0.50951300          0.11745821          0.20578256         -0.90596570
          0.20484530          0.50149748          0.54053298         -0.04591540
          0.08235630          0.37968233         -0.08920980          1.26723600
          0.03294250          0.20021391         -0.87110670         -0.98171750
  1  3  3  4  2
          0.56231110          0.08418120         -0.20789430
          0.27076610          0.45945383         -0.40496500
          0.13038030          0.38017523         -0.17522960
          0.05215210          0.29286740          0.97536728
# SILICON     (17s,12p,5d,4f) -> [6s,5p,3d,2f]
SI Roos-ATZ-ANO
  4
  1  0  0 17  6
     250095.97000000          0.00006815         -0.00001820          0.00000470         -0.00000490          0.00000688         -0.00000870
      35803.20000000          0.00048017         -0.00012780          0.00003305         -0.00003480          0.00004735         -0.00005180
      10522.48300000          0.00159626         -0.00042650          0.00011064         -0.00011490          0.00016522         -0.00023760
       3701.77450000          0.00547507         -0.00146180          0.00037778         -0.00040070          0.00053088         -0.00049020
       1399.39330000          0.01693706         -0.00458450          0.00119120         -0.00123290          0.00179852         -0.00273600
        548.38895000          0.05041784         -0.01387010          0.00359228         -0.00382010          0.00503523         -0.00444650
        219.36269000          0.13450267         -0.03917820          0.01024273         -0.01061380          0.01559960         -0.02415990
         88.88225900          0.29476401         -0.09635060          0.02530364         -0.02708780          0.03568620         -0.03015270
         36.32337700          0.41279726         -0.18176200          0.04932521         -0.05122020          0.07863781         -0.13753650
         14.93346300          0.21885760         -0.14523390          0.04049616         -0.04663010          0.04948931          0.04506541
          6.16634850          0.01352631          0.22989807         -0.06985640          0.09190140         -0.11137450         -0.07232060
          2.55455650          0.00478761          0.62379847         -0.25411200          0.26901327         -0.55229290          1.49441380
          1.06095070         -0.00235090          0.31543582         -0.28611330          0.46077703         -0.38840900         -2.00225000
          0.44150240          0.00157700         -0.00276260          0.24639415         -1.05620100          2.95347820         -0.52493620
          0.18401680         -0.00091180          0.00903722          0.68019181         -0.78471120         -2.85560200          3.77092740
          0.07679620          0.00041644         -0.00390620          0.28966706          1.20426300          0.09215286         -4.55747700
          0.03071850         -0.00011400          0.00111144          0.02414823          0.29679859          1.03482600          2.28671740
  1  1  1 12  5
        843.53382000          0.00074369         -0.00015740          0.00016602         -0.00019250          0.00040030
        204.90726000          0.00552015         -0.00116560          0.00119789         -0.00115190          0.00205111
         72.24878700          0.02411287         -0.00515290          0.00545750         -0.00647660          0.01387012
         27.96136500          0.08883573         -0.01917230          0.01962832         -0.01827540          0.03298719
         11.23228200          0.23494251         -0.05231320          0.05586579         -0.06800600          0.15230781
          4.59693730          0.39732250         -0.09000870          0.09197956         -0.07758320          0.11866287
          1.90148330          0.36181185         -0.09250120          0.11503921         -0.21432990          0.47363973
          0.79178280          0.10524773          0.03870909         -0.06483660          0.25572048         -1.68302500
          0.33116620          0.00256555          0.34152769         -0.68318220          1.07773340          0.83716261
          0.13894230          0.00177329          0.46110561         -0.16360950         -1.24468400          1.19892260
          0.05842570         -0.00045410          0.25855921          0.61750164         -0.38355030         -2.07338700
          0.02337030          0.00017881          0.07566560          0.44097775          1.02251980          1.18870140
  1  2  2  5  3
          2.01053330          0.02221051         -0.00195270          0.13166768
          0.79109810          0.10356980          0.15356092         -0.66150530
          0.31127870          0.50813164          0.48959332         -0.45910920
          0.12248090          0.35117535          0.11387560          1.54430360
          0.04899240          0.25071127         -0.98489900         -0.99944500
  1  3  3  4  2
          0.71849250          0.11009981         -0.17967440
          0.34744460          0.46295659         -0.23375030
          0.16801530          0.32345259         -0.47263890
          0.06720610          0.34355047          1.10869610
# PHOSPHORUS  (17s,12p,5d,4f) -> [6s,5p,3d,2f]
P  Roos-ATZ-ANO
  4
  1  0  0 17  6
     296647.55000000          0.00006562         -0.00001780          0.00000495         -0.00000380          0.00000594         -0.00000860
      42380.03000000          0.00046254         -0.00012560          0.00003483         -0.00002680          0.00004144         -0.00005490
      12503.85600000          0.00152412         -0.00041530          0.00011560         -0.00008660          0.00013959         -0.00021710
       4422.49370000          0.00518926         -0.00141400          0.00039175         -0.00030500          0.00046280         -0.00056060
       1681.84780000          0.01595159         -0.00440030          0.00122727         -0.00091310          0.00148861         -0.00240580
        663.21490000          0.04720087         -0.01323730          0.00367506         -0.00287280          0.00434089         -0.00514180
        267.00585000          0.12619981         -0.03733840          0.01047976         -0.00779880          0.01277688         -0.02090760
        108.89592000          0.27982529         -0.09244400          0.02602575         -0.02049300          0.03096216         -0.03617190
         44.79731400          0.41030382         -0.17908160          0.05218594         -0.03865600          0.06543104         -0.11613130
         18.54031200          0.24188220         -0.16174870          0.04842224         -0.04197400          0.05707014         -0.02312510
          7.70709950          0.02071709          0.19399810         -0.06270700          0.06559604         -0.09386140          0.01864200
          3.21437500          0.00443622          0.62785121         -0.27648210          0.19549449         -0.41005510          1.12156650
          1.34401270         -0.00216870          0.34320722         -0.31132840          0.38636227         -0.48607910         -0.63232570
          0.56308700          0.00148760         -0.00010200          0.27584791         -0.75348860          1.95041420         -2.92756700
          0.23628700         -0.00087720          0.00993085          0.67745539         -0.54814350         -0.29309150          5.81150950
          0.09928110          0.00039698         -0.00418080          0.28560830          0.26985002         -2.30754900         -5.02116300
          0.03971240         -0.00010790          0.00119275          0.01675006          0.97010724          1.77847660          1.92707230
  1  1  1 12  5
       1018.41220000          0.00071159         -0.00016880          0.00015264         -0.00022110          0.00040331
        247.39820000          0.00528387         -0.00125010          0.00110387         -0.00137890          0.00219003
         87.79048200          0.02297828         -0.00550960          0.00500340         -0.00741670          0.01392847
         34.24860000          0.08494327         -0.02057220          0.01814153         -0.02236340          0.03590870
         13.87701400          0.22803285         -0.05717830          0.05241729         -0.07944690          0.15612489
          5.73030980          0.39658377         -0.10153640          0.08911554         -0.10183150          0.14452546
          2.39200680          0.36766734         -0.10487000          0.10677427         -0.22045860          0.41344622
          1.00527670          0.10640781          0.05753445         -0.07211440          0.35066535         -1.65083300
          0.42439290          0.00281028          0.37524649         -0.60909640          0.97783112          0.86123612
          0.17973060          0.00165268          0.45668244         -0.16157330         -1.12189900          1.21750160
          0.07629100         -0.00040110          0.22572156          0.54191860         -0.50591410         -2.11577900
          0.03051640          0.00016315          0.06188888          0.53980064          1.02634120          1.19234360
  1  2  2  5  3
          2.72018530          0.02567866         -0.01281640          0.14954306
          1.07222220          0.12037513          0.17873934         -0.66586430
          0.42264050          0.55955359          0.50423470         -0.40061210
          0.16659330          0.37100935         -0.11770020          1.53419160
          0.06663730          0.12126366         -0.88859820         -1.09500900
  1  3  3  4  2
          0.89440190          0.17144038         -0.37580420
          0.44087230          0.50049572         -0.39497070
          0.21731660          0.37145759          0.26674267
          0.08692660          0.13902900          0.76247795
# SULFUR      (17s,12p,5d,4f) -> [6s,5p,3d,2f]
S  Roos-ATZ-ANO
  4
  1  0  0 17  6
     346348.23000000          0.00006370         -0.00001760          0.00000516         -0.00000380          0.00000585         -0.00000910
      49391.14600000          0.00044935         -0.00012410          0.00003629         -0.00002730          0.00004096         -0.00005710
      14610.99000000          0.00147142         -0.00040760          0.00011970         -0.00008760          0.00013668         -0.00023300
       5187.20950000          0.00498429         -0.00138200          0.00040336         -0.00030730          0.00045296         -0.00056250
       1980.96760000          0.01525241         -0.00427630          0.00125841         -0.00091510          0.00144216         -0.00257760
        784.63139000          0.04494424         -0.01281620          0.00374805         -0.00286710          0.00420970         -0.00506850
        317.32779000          0.12035338         -0.03610970          0.01069509         -0.00777990          0.01231522         -0.02231470
        130.01976000          0.26908335         -0.08987260          0.02665475         -0.02053900          0.03016574         -0.03570240
         53.73820800          0.40722490         -0.17728880          0.05454724         -0.03956760          0.06449660         -0.12800240
         22.34589600          0.25831856         -0.17312010          0.05462756         -0.04600480          0.06268013         -0.02145890
          9.33325120          0.02714669          0.16887115         -0.05692420          0.06098330         -0.08761680         -0.01890560
          3.91118680          0.00400872          0.63115534         -0.29658550          0.20575809         -0.39434690          1.29060600
          1.64320660         -0.00192710          0.36103178         -0.32932730          0.40570893         -0.55180690         -0.88556930
          0.69174560          0.00134644          0.00184135          0.30470795         -0.81899290          1.99993610         -2.71487600
          0.29167360         -0.00081150          0.01069710          0.67383630         -0.44471340         -0.27829840          5.68938710
          0.12314410          0.00036382         -0.00432300          0.27748421          0.18735812         -2.35282500         -4.92890200
          0.04925760         -0.00009870          0.00124248          0.01304772          1.00722580          1.79232710          1.86654110
  1  1  1 12  5
       1129.12690000          0.00077145         -0.00019700          0.00018333         -0.00028000          0.00043230
        274.03515000          0.00572945         -0.00146240          0.00130515         -0.00172590          0.00288638
         97.40258400          0.02477182         -0.00640040          0.00600239         -0.00940080          0.01459323
         38.08551800          0.09109122         -0.02387630          0.02129088         -0.02797840          0.04821802
         15.47103300          0.24064577         -0.06532010          0.06221627         -0.10067960          0.16282315
          6.40565900          0.40976882         -0.11476930          0.09978781         -0.11767160          0.20594756
          2.68128280          0.35226804         -0.10657020          0.11944864         -0.25665430          0.24014052
          1.13000500          0.08382797          0.11048130         -0.15959890          0.68243796         -1.82669700
          0.47839950          0.00271787          0.41795827         -0.67011450          0.66515564          1.80214550
          0.20318050          0.00078655          0.42517813          0.01331064         -1.44513800          0.02939534
          0.08649230          0.00011535          0.19228231          0.64871747          0.12745221         -1.46966500
          0.03459690          0.00003404          0.04207771          0.37095119          0.77294449          1.12615110
  1  2  2  5  3
          3.00536790          0.03293922         -0.03191870          0.15012046
          1.21729760          0.16386221          0.29392107         -0.82383320
          0.49305560          0.58677406          0.46210890         -0.04964110
          0.19970780          0.31916052         -0.32360540          1.32176930
          0.07988310          0.08508563         -0.75561170         -1.11803800
  1  3  3  4  2
          1.10009880          0.20845644         -0.59442000
          0.52721330          0.55071337         -0.33649890
          0.25266270          0.33354097          0.71034940
          0.10106510          0.06724721          0.35946202
# CHLORINE    (17s,12p,5d,4f) -> [6s,5p,3d,2f]
CL Roos-ATZ-ANO
  4
  1  0  0 17  6
     399432.47000000          0.00006215         -0.00001740          0.00000531         -0.00000470          0.00000595         -0.00000920
      56908.83300000          0.00043838         -0.00012290          0.00003739         -0.00003370          0.00004122         -0.00005590
      16874.76900000          0.00142781         -0.00040130          0.00012271         -0.00010830          0.00013955         -0.00024330
       6010.02780000          0.00481620         -0.00135560          0.00041159         -0.00037410          0.00044686         -0.00051850
       2303.28300000          0.01468157         -0.00417440          0.00127960         -0.00112330          0.00146844         -0.00270980
        915.65994000          0.04311398         -0.01247260          0.00379416         -0.00346090          0.00411004         -0.00455620
        371.72009000          0.11558388         -0.03510470          0.01083171         -0.00951860          0.01251189         -0.02342010
        152.89109000          0.26016348         -0.08775020          0.02707379         -0.02486630          0.02954625         -0.03194480
         63.43630300          0.40382380         -0.17564250          0.05631797         -0.04964540          0.06763368         -0.13915220
         26.48172300          0.27179877         -0.18206990          0.05980454         -0.05901320          0.06396442         -0.00532620
         11.10411200          0.03338125          0.14753370         -0.05113350          0.06729192         -0.07622940         -0.08114670
          4.67162890          0.00356211          0.63295111         -0.31267210          0.26850578         -0.44555880          1.49579950
          1.97045200         -0.00165600          0.37614178         -0.34374380          0.51536265         -0.53191500         -1.37186000
          0.83279460          0.00117962          0.00380802          0.32577967         -1.11610500          2.38922930         -2.02018700
          0.35254090         -0.00073110          0.01133746          0.66892575         -0.52914520         -1.29926400          5.24741420
          0.14943410          0.00032425         -0.00444450          0.27170146          0.76655700         -1.50478700         -4.98513400
          0.05977360         -0.00008790          0.00129047          0.01386816          0.59696595          1.65737770          2.06108180
  1  1  1 12  5
       1288.97160000          0.00078181         -0.00021070          0.00020575         -0.00031720          0.00045514
        312.24430000          0.00581729         -0.00157040          0.00146090         -0.00194620          0.00362539
        111.34634000          0.02503057         -0.00683040          0.00673436         -0.01067180          0.01501985
         43.73608700          0.09188004         -0.02552010          0.02376316         -0.03157490          0.06149816
         17.85652400          0.24258072         -0.06974890          0.07010553         -0.11574860          0.16963861
          7.43276590          0.41394424         -0.12387560          0.11161894         -0.12908650          0.28532032
          3.12825380          0.34789086         -0.10851620          0.12978530         -0.27649330          0.03758123
          1.32572140          0.07717314          0.13894281         -0.23354130          0.89183689         -1.85478400
          0.56441910          0.00312835          0.42954359         -0.67189630          0.41342424          2.43376840
          0.24107410          0.00050049          0.40829131          0.10952051         -1.53837700         -0.94026680
          0.10320890          0.00034786          0.18156256          0.66424757          0.46781029         -0.77329620
          0.04128360         -0.00002380          0.03396053          0.30179468          0.59904463          0.92109142
  1  2  2  5  3
          3.62045610          0.03682298         -0.04843800          0.16746529
          1.47757170          0.17638808          0.39297464         -0.94489600
          0.60302300          0.59139283          0.47951806          0.27892621
          0.24610430          0.30996037         -0.56212450          1.04819660
          0.09844170          0.06672018         -0.56257760         -1.12710900
  1  3  3  4  2
          1.35689640          0.22438063         -0.68736230
          0.66136460          0.56956395         -0.26104400
          0.32235560          0.30148671          0.82343588
          0.12894220          0.04940109          0.21671325
# ARGON       (17s,12p,5d,4f) -> [6s,5p,3d,2f]
AR Roos-ATZ-ANO
  4
  1  0  0 17  6
     455476.77000000          0.00006096         -0.00001730          0.00000544         -0.00000530          0.00000579         -0.00001010
      64817.74300000          0.00043020         -0.00012220          0.00003829         -0.00003750          0.00003978         -0.00005880
      19256.98700000          0.00139466         -0.00039690          0.00012513         -0.00012020          0.00013641         -0.00027260
       6877.00730000          0.00468779         -0.00133670          0.00041795         -0.00041340          0.00042380         -0.00051080
       2643.48770000          0.01424066         -0.00409860          0.00129572         -0.00123820          0.00143205         -0.00305700
       1054.23750000          0.04169365         -0.01221340          0.00382578         -0.00379760          0.00386068         -0.00436370
        429.37122000          0.11183053         -0.03433220          0.01092652         -0.01045540          0.01216691         -0.02637120
        177.18859000          0.25298878         -0.08610070          0.02735689         -0.02735260          0.02778303         -0.03036920
         73.76394500          0.40044790         -0.17427680          0.05765806         -0.05546770          0.06724781         -0.16095030
         30.89700700          0.28245090         -0.18902660          0.06394978         -0.06865230          0.06200867          0.01248080
         12.99948200          0.03906305          0.13009718         -0.04572820          0.07055596         -0.06041520         -0.15431860
          5.48767930          0.00314565          0.63399171         -0.32577250          0.30115546         -0.46387010          1.83591150
          2.32257160         -0.00139160          0.38815020         -0.35331040          0.61789886         -0.49311320         -2.05303400
          0.98498070          0.00101034          0.00573222          0.33817566         -1.43377400          2.41394970         -1.20832800
          0.41839730         -0.00064850          0.01193554          0.66223091         -0.27094710         -1.53597500          4.63521250
          0.17795940          0.00028402         -0.00449410          0.27636906          0.77596409         -1.27729400         -4.69611700
          0.07118380         -0.00007710          0.00131952          0.00949692          0.50334371          1.63788950          1.98829450
  1  1  1 12  5
       1462.49620000          0.00078756         -0.00022120          0.00029752         -0.00045430          0.00038932
        354.06731000          0.00586048         -0.00165140          0.00201545         -0.00318150          0.00580901
        126.69779000          0.02510137         -0.00713990          0.00979652         -0.01511580          0.01133247
         49.98909500          0.09200774         -0.02671710          0.03265686         -0.05279920          0.10360929
         20.50929500          0.24317197         -0.07307220          0.10366041         -0.17027200          0.13463887
          8.58046410          0.41674542         -0.13132950          0.14799999         -0.23127500          0.54075660
          3.63010490          0.34542045         -0.10964210          0.20744830         -0.20352810         -0.95625510
          1.54652800          0.07305360          0.16048636         -0.50796850          1.74529250         -0.50691800
          0.66193690          0.00294397          0.43595556         -0.80424020         -1.39630300          2.32780040
          0.28424280         -0.00023940          0.40458441          0.69669502         -0.47271850         -2.63217100
          0.12234630          0.00028995          0.17125106          0.46331690          0.89125570          1.09251950
          0.04893850         -0.00009340          0.01351308          0.04908714          0.06889766          0.35266723
  1  2  2  5  3
          4.32884170          0.04003444         -0.05753400          0.16735357
          1.77423020          0.18334334          0.42320227         -0.96674040
          0.72719060          0.59072873          0.45075094          0.33376377
          0.29804820          0.30437283         -0.56963190          1.00414720
          0.11921930          0.06258812         -0.55102580         -1.11944400
  1  3  3  4  2
          1.63117400          0.23597497         -0.76592680
          0.82032880          0.57618801         -0.17377420
          0.41254910          0.27800823          0.84810472
          0.16501960          0.04019225          0.16638315
# SCANDIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
SC Roos-ATZ-ANO
  5
  1  0  0 21  8
    2715278.00000000          0.00000900         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000
     406598.40000000          0.00007030         -0.00002060          0.00000730         -0.00000180          0.00000260         -0.00000380          0.00000510          0.00000000
      92530.04000000          0.00036940         -0.00010830          0.00003810         -0.00000940          0.00001340         -0.00001890          0.00002330         -0.00000320
      26207.92000000          0.00155730         -0.00045720          0.00016110         -0.00003970          0.00005780         -0.00008580          0.00011740         -0.00001470
       8549.42900000          0.00563820         -0.00166130          0.00058530         -0.00014420          0.00020370         -0.00028470          0.00033930         -0.00004710
       3085.97500000          0.01806450         -0.00537480          0.00189710         -0.00046690          0.00068540         -0.00103110          0.00144770         -0.00017810
       1203.17200000          0.05144550         -0.01567320          0.00554030         -0.00136660          0.00191410         -0.00262930          0.00299550         -0.00042980
        498.48690000          0.12707080         -0.04083870          0.01453930         -0.00358060          0.00531270         -0.00814650          0.01185640         -0.00142260
        216.73600000          0.25490550         -0.09186680          0.03306540         -0.00818040          0.01128470         -0.01500180          0.01553210         -0.00240110
         97.87476000          0.36017450         -0.16483380          0.06115120         -0.01512000          0.02309850         -0.03719520          0.05878880         -0.00667270
         45.20433000          0.26994140         -0.18091270          0.07020760         -0.01759940          0.02223440         -0.02357950          0.00528310         -0.00314330
         20.21187000          0.06163750          0.05165400         -0.02111350          0.00550800          0.00012430         -0.02279820          0.09434560         -0.00609790
          9.57475100         -0.00137010          0.50475000         -0.27065280          0.07005320         -0.12218900          0.23648630         -0.46579960          0.04625290
          4.54034600          0.00205340          0.50458120         -0.44054920          0.12312720         -0.14779690          0.13085050          0.10415480          0.01739340
          1.99568700         -0.00095410          0.09393700          0.06285390         -0.02804590         -0.03470180          0.23841110         -0.88418510          0.04824640
          0.94221500          0.00043550         -0.00297080          0.71691260         -0.24417280          0.64622190         -1.77116600          4.00662690         -0.40686840
          0.41784500         -0.00018700          0.00248250          0.44287950         -0.32519970          0.15556920          1.29776820         -4.97894900          0.46797940
          0.09576100          0.00009670         -0.00080170          0.02330730          0.35832950         -2.27616700          3.27082980          7.87419890          0.69915480
          0.05135100         -0.00009370          0.00076540         -0.01372210          0.60752200          1.15412310         -6.65044700         -9.85628200         -3.30406900
          0.02387800          0.00004130         -0.00033710          0.00463010          0.20971750          0.73089930          4.26392470          5.32791980          4.81968330
          0.00955100         -0.00000960          0.00007800         -0.00096690          0.00735930          0.10275990         -0.71246510         -1.36913800         -2.85896200
  1  1  1 15  7
       4609.88500000          0.00019180         -0.00006450          0.00001890         -0.00002410          0.00003140         -0.00000370          0.00006720
       1092.15600000          0.00168010         -0.00056470          0.00016800         -0.00021600          0.00028190         -0.00009380          0.00033050
        354.33680000          0.00927530         -0.00314160          0.00092260         -0.00117490          0.00153070         -0.00018100          0.00327360
        134.80760000          0.03752900         -0.01284830          0.00383000         -0.00492860          0.00643370         -0.00216920          0.00731900
         56.60258000          0.11490240         -0.04053780          0.01193470         -0.01520350          0.01981900         -0.00187070          0.04399470
         25.33410000          0.25439250         -0.09287680          0.02796510         -0.03616710          0.04726480         -0.01843640          0.04132910
         11.74033000          0.37991660         -0.14765040          0.04354370         -0.05550180          0.07284370          0.00517070          0.21606010
          5.56925900          0.30955560         -0.11280680          0.03528510         -0.04666140          0.06440110         -0.07381960         -0.04754280
          2.59495800          0.08713980          0.15761620         -0.06168620          0.08722140         -0.11917420          0.14285680          0.23806450
          1.19635100          0.00256100          0.47136960         -0.15801900          0.22269450         -0.38254400         -0.09680990         -2.55856900
          0.53505900          0.00122680          0.43009950         -0.22299720          0.36197370         -0.39389800          0.45403420          4.31709930
          0.22077600         -0.00047590          0.10180830          0.15843480         -0.88835790          2.19800400         -1.45299000         -3.68183000
          0.08831000          0.00022640         -0.00184220          0.70244750         -0.40959980         -2.39692000          2.62863880          2.28377620
          0.03532400         -0.00011100          0.00290250          0.28120420          0.91905930          0.89636100         -3.13249300         -1.07370600
          0.01413000          0.00003470         -0.00078270          0.01348200          0.21314870          0.35148690          1.96084820          0.28495100
  1  2  2 10  5
        110.21970000          0.00082590         -0.00072360          0.00088820         -0.00079750          0.00131880
         32.80041000          0.00668110         -0.00582090          0.00727290         -0.00574830          0.01552580
         12.31300000          0.02815940         -0.02479120          0.03053470         -0.02734940          0.04659410
          5.06381900          0.08372590         -0.07372960          0.09263050         -0.07108940          0.20849080
          2.22554700          0.17840110         -0.15786200          0.19890520         -0.19284550          0.28675450
          0.99234300          0.26729480         -0.22085100          0.26567710         -0.17873910          0.58272510
          0.43636100          0.30373220         -0.20962350          0.09014130         -0.03909720         -2.16466900
          0.18570500          0.29501850          0.05386540         -0.65848460          1.37404170          2.18450990
          0.07344100          0.19903620          0.43826460         -0.39701430         -1.98588300         -1.25616900
          0.02937600          0.09880500          0.51004480          0.89538510          1.16147000          0.44271170
  1  3  3  6  3
          2.84150000          0.03457760         -0.09573200          0.13599950
          1.12630000          0.09785270         -0.21698380          0.33213270
          0.44640000          0.34953560         -0.57644500          0.49380450
          0.17690000          0.54494830          0.14682810         -1.24770000
          0.07010000          0.23054040          0.57506500          0.81525440
          0.02780000          0.03096220          0.20992140          0.20469110
  1  4  4  4  2
          1.60710000         -0.03124780         -0.17126050
          0.63170000         -0.19912470         -0.40228810
          0.24830000         -0.43510610          0.05517030
          0.09760000         -0.16454480          0.44274080
# TITANIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
TI Roos-ATZ-ANO
  5
  1  0  0 21  8
    3014643.00000000          0.00000890         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000
     451432.90000000          0.00006930         -0.00002050          0.00000730         -0.00000180          0.00000260         -0.00000530          0.00000530         -0.00000530
     102733.80000000          0.00036440         -0.00010770          0.00003850         -0.00000950          0.00001350         -0.00002630          0.00002920         -0.00003280
      29098.17000000          0.00153640         -0.00045480          0.00016260         -0.00004010          0.00005870         -0.00012000          0.00011610         -0.00011140
       9492.33000000          0.00556280         -0.00165290          0.00059090         -0.00014580          0.00020570         -0.00039620          0.00045570         -0.00053040
       3426.34600000          0.01782860         -0.00534850          0.00191600         -0.00047270          0.00069770         -0.00144350          0.00134220         -0.00122050
       1335.89600000          0.05081180         -0.01560890          0.00559920         -0.00138220          0.00193150         -0.00365790          0.00441360         -0.00535560
        553.50260000          0.12571800         -0.04072220          0.01471710         -0.00363470          0.00543140         -0.01144970          0.01006050         -0.00838210
        240.69250000          0.25299350         -0.09187640          0.03356770         -0.00830710          0.01140250         -0.02093470          0.02766260         -0.03603000
        108.72930000          0.35959430         -0.16550280          0.06237530         -0.01548490          0.02391930         -0.05291360          0.04026960         -0.02489570
         50.26457000          0.27246950         -0.18360090          0.07240540         -0.01810670          0.02240970         -0.03314180          0.07324130         -0.12295430
         22.58004000          0.06359560          0.04772320         -0.01969540          0.00495790          0.00244170         -0.03572990         -0.05679990          0.17036170
         10.71432000         -0.00122450          0.50578510         -0.27814850          0.07274550         -0.12994700          0.34737590         -0.16965990         -0.02547000
          5.09354600          0.00201170          0.50661980         -0.44779230          0.12462260         -0.14412390          0.19621750         -0.76563180          1.42375220
          2.24418300         -0.00093570          0.09464750          0.07571830         -0.03012510         -0.04266210          0.21600550          1.37733270         -3.69996800
          1.05957000          0.00042050         -0.00280280          0.72182450         -0.25472070          0.68771070         -2.54289500          0.71862210          3.42508630
          0.46884900         -0.00017760          0.00244130          0.43305370         -0.31128130          0.08970370          2.53447060         -2.56707700         -1.00954000
          0.10614300          0.00008640         -0.00072980          0.02190390          0.39641780         -2.20071600          0.65481180          5.20872300         -2.39533300
          0.05526200         -0.00008290          0.00069790         -0.01256510          0.58239440          1.16817660         -3.07838800         -5.98295700          5.66622560
          0.02546500          0.00003760         -0.00031470          0.00450140          0.19898060          0.68247570          2.18525880          1.89911920         -5.71171100
          0.01018600         -0.00000900          0.00007490         -0.00096630          0.00465100          0.09670200         -0.12137220          0.47574670          2.69579320
  1  1  1 15  7
       5181.15700000          0.00018720         -0.00006430          0.00001780         -0.00002460          0.00003720         -0.00005500          0.00003440
       1227.46100000          0.00164140         -0.00056350          0.00015780         -0.00021600          0.00030350         -0.00044230          0.00074570
        398.27120000          0.00908300         -0.00314250          0.00086990         -0.00120360          0.00181820         -0.00268410          0.00167520
        151.58670000          0.03689510         -0.01290430          0.00362100         -0.00495220          0.00694320         -0.01009190          0.01739890
         63.69633000          0.11355990         -0.04095070          0.01136290         -0.01573360          0.02391530         -0.03527760          0.01936750
         28.54733000          0.25317900         -0.09460300          0.02679910         -0.03658610          0.05029720         -0.07263650          0.14811200
         13.26129000          0.38016760         -0.15139560          0.04214160         -0.05944900          0.09593970         -0.14494120         -0.00414360
          6.31035200          0.31020000         -0.11414090          0.03368180         -0.04678460          0.05786020         -0.14247940          0.63592460
          2.95187500          0.08777410          0.16320570         -0.05898500          0.07944800         -0.08846610          0.31125940         -1.91295700
          1.36537000          0.00294910          0.47321730         -0.15122720          0.27628380         -0.65664460          1.43894680          1.31107870
          0.61141500          0.00131940          0.42451320         -0.20347950          0.27142190          0.11031280         -2.78088700          0.71779750
          0.25254800         -0.00042150          0.10183770          0.11806170         -0.79246970          1.61485710          1.85240650         -2.24014800
          0.10101900          0.00021980         -0.00167870          0.69383950         -0.46317480         -1.74849600         -0.07210230          2.90907530
          0.04040800         -0.00010630          0.00283920          0.31458520          0.84321160          0.31630340         -1.14942500         -2.70645000
          0.01616300          0.00003320         -0.00076640          0.01638690          0.29045090          0.63388040          0.97774750          1.42394160
  1  2  2 10  5
        134.35650000          0.00082950         -0.00066820          0.00107010         -0.00145030          0.00228580
         40.04189000          0.00686720         -0.00549600          0.00903560         -0.01239650          0.01652190
         15.12976000          0.02978290         -0.02413250          0.03925760         -0.05422370          0.08713510
          6.27699000          0.08973600         -0.07293950          0.12440160         -0.17800620          0.25177540
          2.78141000          0.19339830         -0.15795350          0.25010250         -0.33545420          0.54087000
          1.25360200          0.28934680         -0.21643350          0.28000330         -0.18766830         -0.64286510
          0.55740500          0.31794410         -0.18224060         -0.08899850          0.78380040         -0.80912680
          0.23975900          0.27588610          0.12624550         -0.62602520          0.22363430          1.85337250
          0.09528700          0.15938330          0.44805130         -0.24875410         -1.28760100         -1.65105200
          0.03811500          0.07054350          0.48413330          0.81573960          0.96413090          0.76643890
  1  3  3  6  3
          4.24640000          0.03908400         -0.12201770          0.23859370
          1.68310000          0.13383140         -0.36711890          0.55423570
          0.66710000          0.36510790         -0.49912310         -0.19514490
          0.26440000          0.49496780          0.25518400         -0.73517000
          0.10480000          0.25144470          0.52213820          0.65679220
          0.04150000          0.03832940          0.11207230          0.26902180
  1  4  4  4  2
          2.40170000          0.10522000         -0.38795830
          0.94400000          0.33971690         -0.55192540
          0.37100000          0.56411760          0.18037360
          0.14580000          0.28531140          0.60415490
# VANADIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
V  Roos-ATZ-ANO
  5
  1  0  0 21  8
    3321857.00000000          0.00000880         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     497435.60000000          0.00006870         -0.00002040          0.00000740         -0.00000170          0.00000330         -0.00000540          0.00000520         -0.00000680
     113202.70000000          0.00036100         -0.00010750          0.00003890         -0.00000920          0.00001660         -0.00002720          0.00002910         -0.00004150
      32063.33000000          0.00152210         -0.00045390          0.00016420         -0.00003870          0.00007310         -0.00012220          0.00011320         -0.00014450
      10459.62000000          0.00551160         -0.00165010          0.00059670         -0.00014080          0.00025210         -0.00041000          0.00045530         -0.00066690
       3775.50600000          0.01766850         -0.00534000          0.00193530         -0.00045670          0.00087230         -0.00146550          0.00130150         -0.00160130
       1472.04000000          0.05038290         -0.01559340          0.00565820         -0.00133560          0.00235840         -0.00380660          0.00443920         -0.00669230
        609.93310000          0.12480880         -0.04072340          0.01489220         -0.00351830          0.00683810         -0.01159340          0.00968600         -0.01124660
        265.26340000          0.25172610         -0.09208410          0.03404070         -0.00805470          0.01385690         -0.02209190          0.02820130         -0.04474820
        119.86070000          0.35922650         -0.16636470          0.06349340         -0.01508270          0.03069540         -0.05334350          0.03801970         -0.03654160
         55.44891000          0.27416450         -0.18580410          0.07421810         -0.01773950          0.02615090         -0.03823630          0.07857070         -0.14943220
         24.98372000          0.06486330          0.04585460         -0.01908000          0.00455360          0.00874490         -0.02907220         -0.06832350          0.19110580
         11.88056000         -0.00116620          0.50807060         -0.28571740          0.07165820         -0.17680100          0.34559820         -0.14736410          0.06905680
          5.66031100          0.00198280          0.50692040         -0.45245900          0.12029780         -0.15916140          0.25792820         -0.82902110          1.69200910
          2.49570300         -0.00092240          0.09430990          0.09007790         -0.03297310         -0.08362760          0.02175320          1.63122450         -4.96967400
          1.17786600          0.00040990         -0.00270220          0.72508740         -0.24733060          1.01147820         -2.40280600          0.23192920          5.29396380
          0.52004400         -0.00017020          0.00240070          0.42300420         -0.28548310         -0.22802420          2.70767500         -2.15214700         -2.39720300
          0.11596500          0.00007890         -0.00067900          0.02042980          0.35331150         -2.26950100         -0.25108400          4.89520660         -0.66756870
          0.05893800         -0.00007520          0.00064630         -0.01164770          0.59079650          1.60659870         -2.02543500         -5.96357100          3.38722670
          0.02694600          0.00003490         -0.00029880          0.00432260          0.22227520          0.30163730          1.79308710          2.17030290         -4.30186600
          0.01077800         -0.00000850          0.00007270         -0.00095410          0.00404190          0.13033430         -0.03372380          0.37871370          2.24684740
  1  1  1 15  7
       5777.37700000          0.00018360         -0.00006410          0.00001790         -0.00002930          0.00003760         -0.00005740          0.00004720
       1368.67400000          0.00161110         -0.00056260          0.00015830         -0.00025550          0.00031060         -0.00047960          0.00079790
        444.12330000          0.00893310         -0.00314410          0.00087600         -0.00143690          0.00184300         -0.00281000          0.00232320
        169.09910000          0.03640770         -0.01295560          0.00365290         -0.00589370          0.00715630         -0.01104480          0.01874100
         71.10191000          0.11255930         -0.04131800          0.01154370         -0.01897940          0.02447010         -0.03724580          0.02910050
         31.90311000          0.25238890         -0.09610600          0.02735360         -0.04405560          0.05280940         -0.08169560          0.15830170
         14.85109000          0.38048750         -0.15458390          0.04343200         -0.07318490          0.09891910         -0.15309860          0.05462060
          7.08522700          0.31047820         -0.11487580          0.03382940         -0.05429490          0.06201690         -0.15863690          0.54869930
          3.32442200          0.08808030          0.16825760         -0.06114900          0.10392680         -0.12794370          0.44880840         -2.07482200
          1.54116400          0.00320000          0.47522200         -0.15596350          0.35080200         -0.64800290          1.23670600          1.80041500
          0.69052000          0.00136800          0.41995650         -0.19423340          0.21455920          0.26641430         -2.69004000          0.18305780
          0.28542400         -0.00038780          0.10071520          0.12128510         -0.91179100          1.37800780          1.90754510         -1.88871400
          0.11417000          0.00021440         -0.00165100          0.68002870         -0.29944180         -1.66822500         -0.15905240          2.71073900
          0.04566800         -0.00010280          0.00277480          0.32526770          0.79383860          0.32032510         -1.09269000         -2.58362000
          0.01826700          0.00003210         -0.00074620          0.01640420          0.24053480          0.68719140          0.95690940          1.36049790
  1  2  2 10  5
        155.85270000          0.00082400         -0.00073700          0.00111480         -0.00160610          0.00235870
         46.49771000          0.00690790         -0.00615680          0.00949820         -0.01385620          0.01838360
         17.62999000          0.03046120         -0.02746690          0.04217370         -0.06229780          0.09402230
          7.35467200          0.09234490         -0.08414480          0.13485540         -0.20931580          0.30787650
          3.27405100          0.19856960         -0.18070830          0.27482530         -0.38597190          0.49646650
          1.48248200          0.29427800         -0.23594040          0.27099700         -0.04116230         -0.93727640
          0.66135100          0.31782360         -0.15454830         -0.17801220          0.90020360         -0.26353080
          0.28482600          0.27361460          0.19348160         -0.65249560         -0.17294460          1.51137020
          0.11289900          0.15457840          0.46099510         -0.03686490         -1.00120500         -1.64835400
          0.04516000          0.05137880          0.41547910          0.73380860          0.90394100          0.86279220
  1  3  3  6  3
          5.90660000          0.04103170         -0.11078580          0.24098330
          2.34120000          0.16050070         -0.38304920          0.57916150
          0.92790000          0.39186680         -0.46986320         -0.26821710
          0.36780000          0.46817410          0.29209870         -0.68232650
          0.14580000          0.23292270          0.51792180          0.64138310
          0.05780000          0.03878760          0.11509430          0.26286930
  1  4  4  4  2
          3.34060000          0.09336340         -0.34102680
          1.31300000          0.31083780         -0.51794230
          0.51610000          0.47448500          0.19167130
          0.20280000          0.23905820          0.55279660
# CHROMIUM    (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
CR Roos-ATZ-ANO
  5
  1  0  0 21  8
    6177194.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000120
     924929.50000000          0.00003520         -0.00001060          0.00000380          0.00000000          0.00000160         -0.00000270          0.00000500         -0.00000570
     210486.50000000          0.00018520         -0.00005550          0.00002010         -0.00000480          0.00000920         -0.00001470          0.00002200         -0.00005680
      59620.05000000          0.00078170         -0.00023440          0.00008480         -0.00002000          0.00003570         -0.00005850          0.00011540         -0.00009070
      19450.76000000          0.00284000         -0.00085460          0.00030980         -0.00007390          0.00014470         -0.00022940          0.00031760         -0.00101630
       7022.05600000          0.00919120         -0.00277760          0.00100500         -0.00023660          0.00041230         -0.00068230          0.00144520         -0.00057270
       2738.76300000          0.02681960         -0.00823310          0.00299260         -0.00071610          0.00143310         -0.00225550          0.00281960         -0.01153910
       1135.81400000          0.07006660         -0.02215430          0.00805280         -0.00189060          0.00319370         -0.00535390          0.01243190          0.00082350
        495.09230000          0.15802290         -0.05364420          0.01974040         -0.00475090          0.00983570         -0.01532300          0.01615040         -0.09448890
        224.74870000          0.28468010         -0.11084460          0.04123840         -0.00964650          0.01526100         -0.02636230          0.07299220          0.05848110
        105.38360000          0.34784190         -0.17981180          0.06982360         -0.01712800          0.03887360         -0.05910420          0.03281590         -0.52732410
         50.19359000          0.21469600         -0.15326130          0.06194170         -0.01396960          0.01102890         -0.02750750          0.20421420          0.66490440
         22.24957000          0.03639130          0.15704610         -0.07028210          0.01468510          0.01119260          0.00607140         -0.40665110         -1.95251100
         10.98265000         -0.00233900          0.55798350         -0.35206530          0.09575890         -0.27550750          0.41885790         -0.00596390          7.62914130
          5.38366500          0.00157580          0.40642730         -0.38303600          0.09291530         -0.02447570          0.18358050         -1.93485000        -11.90154000
          2.34368500         -0.00070320          0.05485290          0.26660970         -0.06694350         -0.14028950         -0.34679470          6.13937260         10.92015100
          1.10520200          0.00028400         -0.00183770          0.70724400         -0.30576810          1.39136390         -1.98221100         -6.58541100         -6.81439800
          0.48784800         -0.00010280          0.00145360          0.31331990         -0.17006770         -0.97588370          2.83069160          2.81404490          2.25475520
          0.08959900          0.00002440         -0.00007650          0.00785530          0.74527870         -1.41883500         -1.93940600         -0.03754380         -0.40553220
          0.03342300         -0.00001690          0.00023540         -0.00362720          0.39684270          1.71845830          0.89050600         -1.11094600          0.09131830
          0.01336900          0.00000600         -0.00004620          0.00107930          0.00528540         -0.15218120          0.33550720          1.05236790          0.07126280
  1  1  1 15  7
       6268.92100000          0.00018740         -0.00006560          0.00002110         -0.00004280          0.00004900         -0.00005110          0.00006530
       1485.11800000          0.00164430         -0.00057560          0.00018610         -0.00036790          0.00041520         -0.00051760          0.00088090
        481.91460000          0.00912080         -0.00322040          0.00103810         -0.00210200          0.00240430         -0.00250870          0.00325740
        183.51420000          0.03719650         -0.01327760          0.00430200         -0.00850300          0.00960040         -0.01202570          0.02074720
         77.19005000          0.11492610         -0.04237710          0.01371150         -0.02787310          0.03196840         -0.03290190          0.04256650
         34.65178000          0.25692940         -0.09833830          0.03212880         -0.06332420          0.07142640         -0.09340990          0.17152030
         16.14846000          0.38335940         -0.15697670          0.05144400         -0.10828590          0.12916330         -0.12414110          0.14457120
          7.71093900          0.30473540         -0.10861110          0.03596730         -0.07062480          0.10060060         -0.21379300          0.39092670
          3.60715400          0.08243440          0.18485070         -0.07642230          0.17670900         -0.34212040          0.83665230         -2.42036800
          1.66736200          0.00273620          0.47596480         -0.19422200          0.57084960         -0.83549890          0.34600580          3.06951180
          0.73908800          0.00145720          0.40672300         -0.18560820         -0.03570800          1.41643780         -2.12483100         -1.59571400
          0.30132600         -0.00032910          0.10212740          0.20105820         -1.25601300         -0.04974320          2.48116440         -0.26908320
          0.12053000          0.00022830         -0.00155650          0.68652460          0.40458460         -1.33599800         -1.48346900          1.58828110
          0.04821200         -0.00010210          0.00275350          0.26067750          0.58709910          0.97815560         -0.10461050         -2.07075200
          0.01928500          0.00003220         -0.00077330          0.00171750          0.00688970          0.25778320          0.82880560          1.29901160
  1  2  2 10  5
        150.83410000          0.00118080         -0.00073170          0.00147090         -0.00198190          0.00293040
         44.99723000         -0.03366540          0.00966120         -0.00593860          0.01221630         -0.01633860
         16.96088000          0.04556200          0.03219560          0.04140730         -0.02588100          0.05281200
          7.04015400         -0.15934630          0.37011740         -1.71626000          0.12131660         -0.07615180
          3.10387800          0.37251220         -0.67852770          0.85425730          2.85143560          0.24095390
          1.37589600         -0.36806240          0.35632890          0.49893130         -2.51585300         -2.69098600
          0.59228200          0.23847460          0.09367550         -0.97662770          1.00466890          2.96154990
          0.24213800         -0.07194640         -0.23308910          0.77748430          0.00841510         -2.05693700
          0.09128400          0.23605300          0.19912700         -0.56415040         -0.16503670          1.20105610
          0.03651400          0.54132100          0.09618840          0.30980510         -0.18723120         -0.99837170
  1  3  3  6  3
          7.71390000          0.03904980         -0.09216890          0.20473740
          3.05750000          0.16805150         -0.36090680          0.57457540
          1.21190000          0.40501470         -0.45590560         -0.17144470
          0.48030000          0.45078650          0.24749490         -0.69725310
          0.19040000          0.22761470          0.51827290          0.45746730
          0.07550000          0.05358530          0.19289890          0.41964850
  1  4  4  4  2
          4.36270000          0.09899290          0.25622850
          1.71480000          0.37757710          0.43342790
          0.67400000          0.52313250         -0.12143690
          0.26490000          0.29987330         -0.49414150
# MANGANESE   (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
MN Roos-ATZ-ANO
  5
  1  0  0 21  8
    3960805.00000000          0.00000870         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     593115.50000000          0.00006800         -0.00002050          0.00000750         -0.00000180          0.00000280         -0.00000580          0.00000630         -0.00000740
     134976.80000000          0.00035740         -0.00010780          0.00003960         -0.00000940          0.00001420         -0.00002880          0.00003620         -0.00004250
      38230.67000000          0.00150710         -0.00045530          0.00016750         -0.00003980          0.00006220         -0.00012990          0.00013440         -0.00015830
      12471.54000000          0.00545760         -0.00165520          0.00060840         -0.00014450          0.00021660         -0.00043510          0.00057350         -0.00067290
       4501.74300000          0.01749970         -0.00535760          0.00197440         -0.00046990          0.00074070         -0.00155900          0.00152210         -0.00179950
       1755.21200000          0.04993510         -0.01565660          0.00577530         -0.00137120          0.00203370         -0.00404210          0.00567100         -0.00664250
        727.30390000          0.12388070         -0.04095100          0.01523350         -0.00363220          0.00580330         -0.01236980          0.01108900         -0.01320330
        316.36780000          0.25049690         -0.09287230          0.03492020         -0.00830490          0.01207350         -0.02356150          0.03703100         -0.04346640
        143.00980000          0.35895920         -0.16842450          0.06548770         -0.01572940          0.02604550         -0.05741360          0.04081040         -0.05005720
         66.21805000          0.27590170         -0.18918780          0.07702400         -0.01842520          0.02385160         -0.04110840          0.11359020         -0.13396720
         29.91896000          0.06596040          0.04616510         -0.01954550          0.00436730          0.00485290         -0.03230330         -0.12393240          0.13606090
         14.30318000         -0.00123720          0.51471840         -0.30058260          0.07696050         -0.14730130          0.37768110         -0.10939550          0.27189300
          6.83945100          0.00195630          0.50418490         -0.45625350          0.12103880         -0.14594950          0.26094310         -1.22496100          1.47458610
          3.01237400         -0.00090710          0.09186060          0.12027270         -0.03966160         -0.03547160         -0.00501200          2.76501310         -5.24583100
          1.41880800          0.00039750         -0.00258700          0.72812930         -0.26313840          0.77851700         -2.43265200         -1.14813300          6.31715330
          0.62362400         -0.00015930          0.00230800          0.40324530         -0.26294560         -0.08070840          2.70448470         -1.32801400         -3.56602700
          0.13409800          0.00006830         -0.00059920          0.01779610          0.43299070         -2.04653000         -0.18863590          4.46581210          1.56932110
          0.06554800         -0.00006470          0.00056840         -0.01018190          0.54643390          1.23053960         -1.98447500         -6.15458300          0.05076780
          0.02958400          0.00003130         -0.00027370          0.00400370          0.19067480          0.54467080          1.81069230          3.05964190         -2.17485400
          0.01183400         -0.00000790          0.00006890         -0.00092400         -0.00022150          0.08868420         -0.15215100         -0.17840820          1.72034160
  1  1  1 15  7
       7048.27100000          0.00017840         -0.00006390          0.00001760         -0.00003520          0.00003830         -0.00005470          0.00005400
       1669.67800000          0.00156680         -0.00056100          0.00015600         -0.00030590          0.00032350         -0.00051490          0.00080030
        541.85710000          0.00871540         -0.00314650          0.00086970         -0.00173610          0.00188620         -0.00269970          0.00268300
        206.42950000          0.03571610         -0.01303980          0.00363280         -0.00712210          0.00752970         -0.01202360          0.01893380
         86.89334000          0.11121530         -0.04192160          0.01162420         -0.02325950          0.02535640         -0.03607640          0.03485680
         39.06309000          0.25160510         -0.09857340          0.02770210         -0.05418060          0.05694880         -0.09331070          0.15977680
         18.24725000          0.38123080         -0.15962520          0.04470710         -0.09199500          0.10353020         -0.14166600          0.10213500
          8.74128900          0.31029020         -0.11507290          0.03304800         -0.06717710          0.07872650         -0.20868190          0.50439900
          4.11933200          0.08812070          0.17705150         -0.06260660          0.13777230         -0.19226940          0.67105100         -2.26790500
          1.91480400          0.00359900          0.47737790         -0.16108730          0.46888220         -0.69137230          0.84618020          2.31120110
          0.85789300          0.00145210          0.41264500         -0.17690520          0.10208170          0.61487770         -2.43522800         -0.39412520
          0.35495000         -0.00033420          0.09948660          0.12091270         -1.04596100          0.92077360          1.93810380         -1.48444000
          0.14198000          0.00020600         -0.00159780          0.64429190         -0.06945110         -1.51537700         -0.27090800          2.48652390
          0.05679200         -0.00009730          0.00267830          0.35827300          0.68819970          0.36824920         -1.06543600         -2.44813000
          0.02271700          0.00003030         -0.00071550          0.01972490          0.18214330          0.70160790          0.99859210          1.28274840
  1  2  2 10  5
        199.83570000          0.00086890         -0.00061410          0.00124530         -0.00144350          0.00222580
         59.72176000          0.00740550         -0.00517230          0.01084020         -0.01243060          0.01898880
         22.74772000          0.03343540         -0.02375470          0.04918380         -0.05807330          0.09232560
          9.56500300          0.10222310         -0.07263280          0.16008170         -0.19535270          0.33205020
          4.28549900          0.21763820         -0.15840410          0.32014190         -0.37455660          0.50021710
          1.95097500          0.31388650         -0.20224890          0.26650740          0.04875240         -1.01976300
          0.87279600          0.32265140         -0.12237590         -0.28152510          0.78022240         -0.16460500
          0.37562100          0.24897740          0.19545300         -0.57570980         -0.11241070          1.43493640
          0.14800900          0.11555480          0.39788320         -0.07034260         -1.10424800         -1.56622400
          0.05920400          0.03978050          0.51436970          0.67373320          0.97098940          0.78798750
  1  3  3  6  3
          9.54130000          0.03498520         -0.08024420          0.16572790
          3.78180000          0.15976610         -0.34830930          0.57437760
          1.49900000          0.39648690         -0.47839020         -0.10199290
          0.59410000          0.45515610          0.22560180         -0.75240290
          0.23550000          0.23977600          0.52997080          0.45286160
          0.09330000          0.05663870          0.19214410          0.43555180
  1  4  4  4  2
          5.39630000          0.08170020         -0.30311870
          2.12100000          0.34540710         -0.60667150
          0.83370000          0.52930680          0.11185800
          0.32770000          0.34012540          0.65216470
# IRON        (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
FE Roos-ATZ-ANO
  5
  1  0  0 21  8
    4316265.00000000          0.00000870         -0.00000260          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     646342.40000000          0.00006760         -0.00002020          0.00000660         -0.00000180          0.00000270         -0.00000570          0.00000590         -0.00000700
     147089.70000000          0.00035510         -0.00010650          0.00003470         -0.00000940          0.00001400         -0.00002870          0.00003390         -0.00004070
      41661.52000000          0.00149760         -0.00044950          0.00014670         -0.00003970          0.00006110         -0.00012810          0.00012630         -0.00015070
      13590.77000000          0.00542370         -0.00163470          0.00053290         -0.00014380          0.00021330         -0.00043330          0.00053680         -0.00064370
       4905.75000000          0.01739500         -0.00529340          0.00173040         -0.00046800          0.00072770         -0.00153520          0.00143200         -0.00171170
       1912.74600000          0.04966290         -0.01548620          0.00506480         -0.00136580          0.00200470         -0.00403960          0.00530520         -0.00636670
        792.60430000          0.12335570         -0.04059850          0.01338920         -0.00362260          0.00570610         -0.01216330          0.01046250         -0.01252690
        344.80650000          0.25002290         -0.09250400          0.03080250         -0.00829640          0.01195170         -0.02374360          0.03466550         -0.04179840
        155.89990000          0.35990370         -0.16905000          0.05821830         -0.01577060          0.02569760         -0.05631410          0.03881310         -0.04704460
         72.23091000          0.27899280         -0.19228400          0.06938660         -0.01858720          0.02403850         -0.04348580          0.10640660         -0.13008460
         32.72506000          0.06684860          0.04532080         -0.01668270          0.00410360          0.00461020         -0.02746690         -0.11425850          0.13536570
         15.66762000         -0.00530450          0.52919120         -0.28071900          0.07759400         -0.14507200          0.35854230         -0.08055550          0.16628850
          7.50348300         -0.00219420          0.52613700         -0.43502950          0.12054490         -0.14701850          0.29723730         -1.22133900          1.70571700
          3.31222300         -0.00156720          0.08634040          0.13102650         -0.04091310         -0.02284040         -0.05560670          2.62540500         -5.39768900
          1.55847100          0.00070060         -0.03666660          0.72871520         -0.26246710          0.74958120         -2.35786300         -0.96387930          6.18158200
          0.68391400         -0.00001330         -0.01644200          0.39852760         -0.25768170         -0.07729630          2.62219710         -1.39819200         -3.26150500
          0.14675700          0.00007580         -0.00138020          0.01733970          0.43339760         -1.92800900         -0.09696180          4.14947270          0.90032800
          0.07058300         -0.00006820          0.00098670         -0.00966160          0.54662560          1.06569450         -1.99104900         -5.40974900          0.99723150
          0.03144900          0.00003290         -0.00043850          0.00385200          0.18747110          0.60856320          1.72090500          2.35644950         -2.75224800
          0.01258000         -0.00000840          0.00010900         -0.00090970          0.00270480          0.09196060         -0.10051950          0.12730230          1.86209100
  1  1  1 15  7
       7721.48900000          0.00017940         -0.00005530          0.00001830         -0.00003460          0.00003990         -0.00005450          0.00006250
       1829.12600000          0.00157650         -0.00048580          0.00016140         -0.00030210          0.00034850         -0.00056600          0.00080570
        593.62800000          0.00878210         -0.00273220          0.00090230         -0.00170710          0.00197160         -0.00269790          0.00309860
        226.20540000          0.03607770         -0.01136920          0.00377270         -0.00706390          0.00815410         -0.01330770          0.01915800
         95.26145000          0.11272930         -0.03684800          0.01213510         -0.02300820          0.02661730         -0.03603850          0.04130870
         42.85920000          0.25609280         -0.08750780          0.02898860         -0.05424340          0.06262640         -0.10609660          0.16004550
         20.04971000          0.38909430         -0.14330720          0.04708140         -0.09111680          0.10665340         -0.13086550          0.14569940
          9.62088500          0.31513030         -0.09976090          0.03395630         -0.06773050          0.09339330         -0.27286100          0.46212610
          4.54137100          0.07892750          0.18578570         -0.06721070          0.14812740         -0.23558910          0.87476560         -2.46528000
          2.11350000         -0.01959520          0.47909010         -0.17287650          0.46037010         -0.68343630          0.58764220          2.86141310
          0.94720100         -0.01837930          0.40815100         -0.16620750          0.03915710          0.63114560         -2.29424000         -1.06044600
          0.39124300         -0.00505370          0.09750330          0.14589740         -0.91332880          0.89696110          1.92836100         -0.96776360
          0.15649700          0.00027940         -0.00155180          0.61178550         -0.15696580         -1.38206000         -0.28128930          2.16152290
          0.06259900         -0.00022310          0.00263140          0.35925890          0.64005450          0.16944950         -1.03870800         -2.25377400
          0.02504000          0.00006380         -0.00070260          0.04073560          0.28359880          0.76562060          0.93879990          1.18630030
  1  2  2 10  5
        217.36880000          0.00090860         -0.00072370          0.00125890         -0.00161930          0.00209630
         64.99976000          0.00775700         -0.00612900          0.01092110         -0.01394030          0.01981100
         24.77314000          0.03509610         -0.02813160          0.04980140         -0.06542380          0.08767690
         10.43614000          0.10690640         -0.08623050          0.16077490         -0.22105340          0.35342280
          4.67965300          0.22354780         -0.18379140          0.32346140         -0.41836770          0.46566330
          2.12562200          0.31482280         -0.22300410          0.24231990          0.18487330         -1.18418500
          0.94524200          0.31706310         -0.09948400         -0.34487070          0.78688110          0.22287920
          0.40268500          0.24533970          0.24250460         -0.54964040         -0.34311580          1.12168860
          0.15665100          0.11980180          0.42175960          0.03680090         -0.87041820         -1.51115100
          0.06266000          0.04248370          0.43580570          0.65109530          0.90154760          0.84889270
  1  3  3  6  3
         11.27490000          0.03258760         -0.07378730          0.15048480
          4.46900000          0.15612850         -0.35717230          0.61759580
          1.77130000          0.40094740         -0.48333090         -0.15246510
          0.70210000          0.45321070          0.23975430         -0.74400380
          0.27830000          0.23899830          0.52100980          0.50331810
          0.11030000          0.05966160          0.18732480          0.38453650
  1  4  4  4  2
          6.37680000         -0.07181810         -0.29275760
          2.50640000         -0.35672040         -0.60349290
          0.98510000         -0.51716410          0.16179090
          0.38720000         -0.29398480          0.62253900
# COBALT      (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
CO Roos-ATZ-ANO
  5
  1  0  0 21  8
    4676708.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000100
     700317.20000000          0.00006700         -0.00002040          0.00000760         -0.00000170          0.00000350         -0.00000550          0.00000500         -0.00000730
     159373.00000000          0.00035240         -0.00010750          0.00004000         -0.00000890          0.00001770         -0.00002790          0.00002820         -0.00004220
      45140.67000000          0.00148620         -0.00045380          0.00016920         -0.00003790          0.00007790         -0.00012220          0.00010730         -0.00015810
      14725.75000000          0.00538250         -0.00165000          0.00061480         -0.00013730          0.00026890         -0.00042470          0.00044430         -0.00066600
       5315.44800000          0.01726470         -0.00534190          0.00199590         -0.00044680          0.00093000         -0.00145680          0.00122610         -0.00180440
       2072.49800000          0.04930400         -0.01562390          0.00584290         -0.00130530          0.00252090         -0.00399180          0.00436640         -0.00656500
        858.82310000          0.12253550         -0.04092880          0.01543990         -0.00346240          0.00732690         -0.01146260          0.00906970         -0.01329910
        373.64370000          0.24860380         -0.09312740          0.03551540         -0.00794870          0.01498120         -0.02386790          0.02829760         -0.04290580
        168.96820000          0.35837910         -0.16965500          0.06696130         -0.01512480          0.03342110         -0.05222480          0.03494890         -0.05088960
         78.31971000          0.27841060         -0.19245090          0.07961680         -0.01794030          0.02931210         -0.04836930          0.08403480         -0.13104100
         35.53724000          0.06785880          0.04347140         -0.01872100          0.00395780          0.00996530         -0.01193170         -0.08208740          0.13014280
         17.04735000         -0.00115750          0.51737040         -0.31042280          0.07479190         -0.19610040          0.30946350         -0.08532520          0.14081640
          8.17553400          0.00192300          0.50464650         -0.46054150          0.11490080         -0.17626490          0.39054300         -0.99683840          1.90270160
          3.61157800         -0.00088960          0.09201290          0.13587240         -0.04223380         -0.03861910         -0.28532140          2.06965250         -5.66431000
          1.69746800          0.00038520         -0.00234550          0.73020260         -0.24686420          1.08415130         -2.05903400         -0.52725830          6.13287560
          0.74363600         -0.00015140          0.00224230          0.39330010         -0.24198820         -0.42626710          2.57812780         -1.41835500         -2.89561700
          0.15832500          0.00006130         -0.00053850          0.01679520          0.37226090         -1.91956200         -0.61815020          3.49227510         -0.04434280
          0.07500900         -0.00005670          0.00050120         -0.00930160          0.56759560          1.37322520         -1.30766700         -4.08162000          2.30677710
          0.03309300          0.00002780         -0.00024560          0.00375190          0.21737940          0.27764580          1.32262520          1.06531310         -3.40497900
          0.01323700         -0.00000730          0.00006420         -0.00090600          0.00352470          0.13569010          0.10033550          0.75922510          1.87662620
  1  1  1 15  7
       8421.84200000          0.00017490         -0.00006400          0.00001880         -0.00003830          0.00003990         -0.00005370          0.00006910
       1995.00000000          0.00153770         -0.00056240          0.00016620         -0.00033620          0.00035810         -0.00059270          0.00077510
        647.48550000          0.00857460         -0.00316260          0.00093160         -0.00189450          0.00197280         -0.00266360          0.00343880
        246.77950000          0.03528970         -0.01316530          0.00389910         -0.00789320          0.00841770         -0.01400160          0.01847170
        103.96890000          0.11048560         -0.04258770          0.01259830         -0.02567960          0.02674400         -0.03561910          0.04674610
         46.81052000          0.25156270         -0.10095360          0.03016540         -0.06112280          0.06551270         -0.11341290          0.15132130
         21.92703000          0.38208840         -0.16409550          0.04922890         -0.10201960          0.10577100         -0.12402180          0.19630070
         10.53715000          0.30945670         -0.11461140          0.03475150         -0.07728850          0.10794080         -0.31891370          0.38612870
          4.98067800          0.08757280          0.18585070         -0.07188090          0.18257780         -0.29257760          1.05617000         -2.54420900
          2.31982400          0.00382660          0.48071240         -0.18284560          0.51785750         -0.65412750          0.30098160          3.24317070
          1.03960900          0.00151230          0.40513110         -0.15347360         -0.05554230          0.76754230         -2.12182000         -1.60291700
          0.42892100         -0.00028530          0.09651020          0.15599370         -0.93997170          0.67550470          1.98305320         -0.49723420
          0.17156800          0.00020140         -0.00155780          0.59752060         -0.05577780         -1.32197400         -0.43478180          1.84870480
          0.06862700         -0.00009280          0.00261270          0.36419420          0.61553970          0.22022440         -0.93174570         -2.08922500
          0.02745100          0.00002890         -0.00069720          0.04018450          0.23599690          0.76020010          0.91738300          1.13243920
  1  2  2 10  5
        237.59280000          0.00092700         -0.00084720          0.00120630         -0.00171410          0.00205160
         71.08881000          0.00793870         -0.00721600          0.01046470         -0.01490830          0.02182970
         27.11903000          0.03606410         -0.03323240          0.04802990         -0.06950530          0.08697790
         11.44826000          0.10968160         -0.10231590          0.15456280         -0.23750360          0.39857290
          5.13954200          0.22645780         -0.21395030          0.31068290         -0.45108020          0.41507500
          2.33269400          0.31367760         -0.24295660          0.20905210          0.26005330         -1.33335300
          1.03403000          0.31243550         -0.06620310         -0.35934790          0.80108240          0.58326830
          0.43789900          0.24628330          0.29378190         -0.51288440         -0.47137080          0.79678900
          0.16896300          0.12633170          0.41673020          0.07429740         -0.71721040         -1.37039400
          0.06758500          0.03900340          0.37130920          0.68550190          0.82498910          0.82987170
  1  3  3  6  3
         12.84030000          0.03236910         -0.07453890          0.14591660
          5.08940000          0.15788750         -0.37667740          0.63322140
          2.01720000          0.41073330         -0.47481310         -0.20378170
          0.79960000          0.45170690          0.27648130         -0.71363400
          0.31690000          0.22855470          0.50315310          0.53295500
          0.12560000          0.05597530          0.17676000          0.36751160
  1  4  4  4  2
          7.26210000         -0.05941470          0.31279870
          2.85440000         -0.34983510          0.62959060
          1.12190000         -0.50665640         -0.21050110
          0.44100000         -0.27189220         -0.60009940
# NICKEL      (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
NI Roos-ATZ-ANO
  5
  1  0  0 21  8
    5048010.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000110
     755918.10000000          0.00006680         -0.00002040          0.00000770         -0.00000170          0.00000360         -0.00000560          0.00000630         -0.00000900
     172026.20000000          0.00035100         -0.00010760          0.00004030         -0.00000890          0.00001810         -0.00002900          0.00003640         -0.00004420
      48724.57000000          0.00148020         -0.00045410          0.00017020         -0.00003750          0.00007960         -0.00012620          0.00013480         -0.00020330
      15894.89000000          0.00536130         -0.00165120          0.00061850         -0.00013620          0.00027480         -0.00044210          0.00057700         -0.00066150
       5737.46800000          0.01719850         -0.00534630          0.00200800         -0.00044320          0.00094960         -0.00150170          0.00152700         -0.00246440
       2237.05100000          0.04912750         -0.01564110          0.00587970         -0.00129480          0.00257820         -0.00416600          0.00571490         -0.00610190
        927.03020000          0.12216700         -0.04099880          0.01554880         -0.00343810          0.00748690         -0.01179840          0.01115040         -0.01987330
        403.34610000          0.24810880         -0.09339290          0.03580900         -0.00790000          0.01536150         -0.02506610          0.03757780         -0.03554580
        182.42820000          0.35826230         -0.17040030          0.06764850         -0.01506930          0.03423590         -0.05358670          0.04129610         -0.09667710
         84.58917000          0.27910230         -0.19374000          0.08065480         -0.01791070          0.03032360         -0.05236170          0.11727590         -0.05833300
         38.42293000          0.06830140          0.04354050         -0.01892620          0.00392190          0.00992020         -0.00783680         -0.12728780         -0.09347020
         18.46879000         -0.00118350          0.51950270         -0.31545840          0.07504680         -0.20137340          0.31051000         -0.05821800          0.75915220
          8.86819000          0.00191620          0.50372390         -0.46110780          0.11324250         -0.18303880          0.44043500         -1.49958200          1.30065970
          3.91887000         -0.00088450          0.09139080          0.14489870         -0.04393570         -0.02175280         -0.39622500          3.49240710         -6.12425400
          1.83985300          0.00038170         -0.00227360          0.73044870         -0.24438380          1.09749980         -2.00536500         -2.19076500          8.02386720
          0.80466300         -0.00014830          0.00220820          0.38778550         -0.23485420         -0.46797710          2.63047080         -0.54559010         -5.04603200
          0.16984600          0.00005850         -0.00051330          0.01622800          0.36865540         -1.85498200         -0.80559900          3.59606440          3.82795330
          0.07937000         -0.00005370          0.00047480         -0.00891480          0.57243370          1.32221160         -1.12092700         -5.23758600         -3.83962400
          0.03470000          0.00002660         -0.00023480          0.00364400          0.21592430          0.29731170          1.36863090          2.76688540          1.38030780
          0.01388000         -0.00000710          0.00006240         -0.00089650          0.00028770          0.11571620         -0.01542830         -0.16839860          0.13715750
  1  1  1 15  7
       9148.79600000          0.00017360         -0.00006400          0.00001960         -0.00004290          0.00004470         -0.00004950          0.00007490
       2167.17100000          0.00152660         -0.00056290          0.00017310         -0.00037840          0.00042100         -0.00057910          0.00072140
        703.38570000          0.00852130         -0.00316920          0.00097220         -0.00212800          0.00221460         -0.00245930          0.00372750
        268.13420000          0.03513410         -0.01321830          0.00407440         -0.00891460          0.00994010         -0.01374210          0.01723880
        113.00780000          0.11025030         -0.04287100          0.01321020         -0.02898040          0.03007480         -0.03294680          0.05160920
         50.91339000          0.25168060         -0.10196740          0.03171290         -0.06949990          0.07851530         -0.11296890          0.13785590
         23.87740000          0.38250460         -0.16592570          0.05192370         -0.11563460          0.11657620         -0.11265270          0.24807380
         11.48924000          0.30893670         -0.11411670          0.03605130         -0.09018240          0.15823130         -0.33933110          0.26394790
          5.43688400          0.08722900          0.18968800         -0.07725320          0.22442350         -0.46936450          1.23179260         -2.46405900
          2.53383700          0.00392060          0.48171720         -0.19414970          0.59429600         -0.66531670         -0.17715500          3.41213180
          1.13530900          0.00153920          0.40202030         -0.14772330         -0.16225690          1.24799050         -1.71378400         -2.01147200
          0.46789100         -0.00026550          0.09551930          0.17187530         -1.03404300          0.06088250          2.09813720         -0.04219670
          0.18715600          0.00019940         -0.00154890          0.60426630          0.15003200         -1.22401600         -0.94192350          1.52019810
          0.07486200         -0.00009090          0.00258830          0.35544100          0.61273400          0.59511470         -0.58235760         -1.98531700
          0.02994500          0.00002840         -0.00069060          0.02125060          0.09486060          0.50804730          0.95110920          1.17899740
  1  2  2 10  5
        258.86670000          0.00095250         -0.00092610          0.00123660         -0.00177870          0.00201940
         77.49604000          0.00817990         -0.00792440          0.01074820         -0.01571750          0.02331780
         29.58972000          0.03730820         -0.03662670          0.04958940         -0.07273200          0.08728670
         12.51527000          0.11328720         -0.11305370          0.15987740         -0.25411760          0.43666370
          5.62446800          0.23147570         -0.23263250          0.31923220         -0.46309120          0.33746420
          2.55130300          0.31613600         -0.24935030          0.17919010          0.36602760         -1.39216000
          1.12806000          0.31084320         -0.03532690         -0.41307200          0.75610370          0.84327470
          0.47537300          0.24210240          0.32694740         -0.47494000         -0.60471820          0.52596860
          0.18212800          0.12298390          0.41969840          0.17118430         -0.55810490         -1.25860300
          0.07285100          0.03516760          0.31817540          0.63979400          0.78181900          0.83751330
  1  3  3  6  3
         14.21560000          0.03449540         -0.07796490          0.15327660
          5.63450000          0.16793190         -0.39359110          0.64450370
          2.23330000          0.42354040         -0.45649420         -0.26415270
          0.88520000          0.44325990          0.31147600         -0.67746640
          0.35090000          0.21579090          0.49201070          0.56328290
          0.13910000          0.05136220          0.16482550          0.34102040
  1  4  4  4  2
          8.03990000          0.06441670          0.23374940
          3.16010000          0.39422640          0.43638820
          1.24210000          0.54552060         -0.18016960
          0.48820000          0.26876230         -0.40409970
# COPPER      (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
CU Roos-ATZ-ANO
  5
  1  0  0 21  8
    9148883.00000000          0.00000450         -0.00000140          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000          0.00000000
    1369956.00000000          0.00003470         -0.00001070          0.00000400          0.00000000          0.00000170         -0.00000290          0.00000450         -0.00000230
     311782.60000000          0.00018240         -0.00005610          0.00002100         -0.00000450          0.00000940         -0.00001540          0.00002310         -0.00002080
      88318.80000000          0.00077000         -0.00023700          0.00008860         -0.00001870          0.00003650         -0.00006340          0.00010180         -0.00004030
      28815.53000000          0.00279760         -0.00086380          0.00032360         -0.00006950          0.00014820         -0.00023880          0.00035130         -0.00036510
      10403.46000000          0.00905600         -0.00280830          0.00105020         -0.00022030          0.00042260         -0.00074630          0.00122040         -0.00031450
       4057.79100000          0.02644080         -0.00832980          0.00312940         -0.00067530          0.00147000         -0.00232870          0.00335440         -0.00407660
       1682.97400000          0.06918040         -0.02245400          0.00843860         -0.00176120          0.00328320         -0.00594890          0.00999050         -0.00081870
        733.75430000          0.15647990         -0.05456570          0.02077020         -0.00452220          0.01014890         -0.01569050          0.02190010         -0.03274590
        333.26770000          0.28318800         -0.11339210          0.04369710         -0.00904300          0.01588480         -0.03044290          0.05407200          0.01311410
        156.43380000          0.34834740         -0.18512600          0.07460190         -0.01670180          0.04068720         -0.05907700          0.07563410         -0.17835700
         74.69721000          0.21729720         -0.15873810          0.06696040         -0.01288420          0.01192630         -0.04167230          0.10389400          0.21183130
         33.32262000          0.03723950          0.16600910         -0.07944260          0.01333560          0.01022030          0.03684610         -0.14016800         -0.65625550
         16.62237000         -0.00258070          0.56808840         -0.38487520          0.09790590         -0.29168770          0.38295340         -0.51266650          2.25317130
          8.20826000          0.00156040          0.39505050         -0.37246620          0.07249740         -0.02332030          0.36386430         -1.35039800         -2.36524200
          3.60940000         -0.00067990          0.05193440          0.31938580         -0.06056550         -0.06553060         -0.83790950          5.69338790         -0.04477630
          1.68344900          0.00026190         -0.00105780          0.70435860         -0.29718440          1.32294460         -1.33277500         -6.48947600          2.02007030
          0.73375700         -0.00008680          0.00123940          0.27996240         -0.10637610         -1.05594100          2.35852380          2.95092940         -1.74255400
          0.11020700          0.00001770         -0.00011970          0.00579100          0.79532710         -1.23087800         -1.82846500         -0.33495160          1.87734720
          0.03878600         -0.00001290          0.00008860         -0.00266520          0.30758250          1.65313940          1.20324560         -0.67362260         -3.24805400
          0.01551400          0.00000490         -0.00003400          0.00095220          0.01483550         -0.20155160          0.04477910          0.84894100          2.28299140
  1  1  1 15  7
       9713.25300000          0.00017840         -0.00006580          0.00002260         -0.00004700          0.00004950         -0.00004950          0.00008520
       2300.88900000          0.00156860         -0.00057820          0.00019820         -0.00041560          0.00048660         -0.00057500          0.00066690
        746.77060000          0.00875430         -0.00325660          0.00112040         -0.00232770          0.00245540         -0.00245860          0.00423610
        284.68060000          0.03608110         -0.01357800          0.00466570         -0.00979250          0.01150310         -0.01366260          0.01591960
        119.99990000          0.11299150         -0.04399850          0.01521570         -0.03165890          0.03321540         -0.03298940          0.05943580
         54.07386000          0.25664090         -0.10418090          0.03608110         -0.07599310          0.09109850         -0.11166080          0.12028890
         25.37321000          0.38518750         -0.16768020          0.05925500         -0.12447490          0.12482900         -0.11756650          0.32080280
         12.20962000          0.30288080         -0.10714430          0.03709930         -0.09551570          0.19632250         -0.31552630          0.05813440
          5.75742100          0.08164480          0.20500460         -0.09339450          0.27896170         -0.67869170          1.38184500         -2.24967500
          2.67340200          0.00338810          0.48293960         -0.22900240          0.62767590         -0.49863740         -0.71329270          3.46521320
          1.18683500          0.00157700          0.39022330         -0.12323690         -0.32615190          1.47981130         -1.10903600         -2.38153200
          0.48159300         -0.00022080          0.09437740          0.23118240         -1.00099000         -0.46342030          1.92129990          0.45280510
          0.19263700          0.00021200         -0.00154480          0.60241090          0.33267140         -0.93055400         -1.20000300          1.12676700
          0.07705500         -0.00008950          0.00264390          0.30652420          0.54404040          0.69217010         -0.31796600         -1.81213600
          0.03082200          0.00002840         -0.00072740          0.01307760          0.05542390          0.36845720          0.93548990          1.16594150
  1  2  2 10  5
        249.34970000          0.00126400         -0.00155310          0.00186920         -0.00233540          0.00250410
         74.63837000          0.01063890         -0.01311300          0.01612510         -0.02290710          0.03579450
         28.37641000          0.04720950         -0.05895500          0.07240920         -0.09394700          0.11182290
         11.94893000          0.13793660         -0.17782060          0.23628630         -0.37675940          0.69073690
          5.31764600          0.26266750         -0.32716810          0.38296120         -0.32713530         -0.47089260
          2.36441700          0.33241630         -0.24099740         -0.16793750          0.95009690         -0.93387540
          1.01238600          0.30779900          0.18960650         -0.68246030         -0.04648790          1.66534460
          0.40677300          0.21664100          0.50340450          0.08869930         -0.88560220         -1.12144000
          0.14733100          0.08407720          0.30703590          0.60278640          0.54282850          0.03505110
          0.05893200          0.00504380          0.03253970          0.14438100          0.32722400          0.52780360
  1  3  3  6  3
         15.43330000          0.03901820         -0.08437670          0.16168310
          6.11720000          0.18754340         -0.41437330          0.63482610
          2.42460000          0.44621250         -0.41723570         -0.31075760
          0.96100000          0.42647410          0.35876800         -0.63188760
          0.38090000          0.19155910          0.47774570          0.56734020
          0.15100000          0.04165180          0.15423760          0.35009790
  1  4  4  4  2
          8.72860000          0.06945940         -0.37915410
          3.43080000          0.43698750         -0.59662630
          1.34850000          0.54147510          0.36137810
          0.53000000          0.21743970          0.51267840
# ZINC        (21s,15p,10d,6f,4g) -> [8s,7p,5d,3f,2g]
ZN Roos-ATZ-ANO
  5
  1  0  0 21  8
    5820021.00000000          0.00000860         -0.00000260          0.00000100          0.00000000          0.00000000          0.00000000          0.00000000         -0.00000110
     871523.40000000          0.00006650         -0.00002050          0.00000780         -0.00000170          0.00000270         -0.00000590          0.00000620         -0.00000870
     198335.00000000          0.00034950         -0.00010800          0.00004080         -0.00000910          0.00001370         -0.00003010          0.00003550         -0.00004410
      56176.31000000          0.00147380         -0.00045590          0.00017230         -0.00003860          0.00005980         -0.00013300          0.00013450         -0.00019630
      18325.82000000          0.00533830         -0.00165780          0.00062590         -0.00013990          0.00020950         -0.00045660          0.00055910         -0.00066710
       6614.95500000          0.01712710         -0.00536850          0.00203290         -0.00045590          0.00071120         -0.00158960          0.00153650         -0.00235740
       2579.19900000          0.04894090         -0.01571240          0.00595460         -0.00133090          0.00197450         -0.00428140          0.00550530         -0.00624260
       1068.84900000          0.12179340         -0.04122570          0.01576690         -0.00354270          0.00559090         -0.01258460          0.01138320         -0.01879910
        465.10450000          0.24765890         -0.09406410          0.03637540         -0.00814300          0.01189240         -0.02556620          0.03591620         -0.03741000
        210.41300000          0.35824320         -0.17199640          0.06892730         -0.01561320          0.02539150         -0.05827530          0.04414830         -0.08931210
         97.61629000          0.27981700         -0.19585000          0.08237330         -0.01853580          0.02475170         -0.05034830          0.10815450         -0.07339220
         44.38020000          0.06857580          0.04532440         -0.02009310          0.00413200          0.00312860         -0.02002860         -0.10561150         -0.05598320
         21.42308000         -0.00131270          0.52445220         -0.32530080          0.07898840         -0.14558310          0.36143710         -0.11899220          0.69639940
         10.30891000          0.00191630          0.50060100         -0.46020860          0.11413160         -0.14872710          0.36964340         -1.30557700          1.27778720
          4.55364500         -0.00087910          0.08947690          0.16339080         -0.04867670          0.03235680         -0.27535280          3.03037740         -5.79535100
          2.13282100          0.00037780         -0.00217430          0.72999360         -0.25153870          0.66517080         -2.09870600         -1.56620700          7.35018950
          0.92969700         -0.00014330          0.00213750          0.37667470         -0.23375600         -0.09666510          2.46453010         -0.95620310         -4.35362100
          0.19214700          0.00005410         -0.00046910          0.01508170          0.43801720         -1.65751300         -0.10951070          3.60138580          2.53567550
          0.08759500         -0.00004910          0.00043030         -0.00822400          0.55217390          0.75108880         -1.76128800         -4.88296500         -1.74265200
          0.03770200          0.00002470         -0.00021650          0.00344840          0.16985730          0.73491840          1.53073600          2.36980120         -0.38523160
          0.01508100         -0.00000670          0.00005910         -0.00087620          0.00249730          0.07323190         -0.07747830         -0.03405900          0.89112170
  1  1  1 15  7
      10684.58000000          0.00017140         -0.00006410          0.00001680         -0.00003600          0.00004200         -0.00005340          0.00007280
       2530.90300000          0.00150870         -0.00056380          0.00014820         -0.00031830          0.00037880         -0.00055550          0.00073030
        821.48200000          0.00843680         -0.00318040          0.00083380         -0.00178740          0.00208760         -0.00265780          0.00363330
        313.25220000          0.03489610         -0.01331030          0.00350650         -0.00753410          0.00897610         -0.01321770          0.01751550
        132.10940000          0.10993590         -0.04336340          0.01141350         -0.02449690          0.02862580         -0.03621650          0.05048070
         59.58751000          0.25205640         -0.10373190          0.02756400         -0.05930450          0.07089200         -0.10721320          0.14163670
         28.00399000          0.38327840         -0.16900020          0.04514620         -0.09830750          0.11494810         -0.13684650          0.23802270
         13.50425000          0.30782600         -0.11286720          0.03039090         -0.07579650          0.11746310         -0.28150200          0.29538670
          6.40188100          0.08651150          0.19638980         -0.06646510          0.18815810         -0.33659140          1.01539170         -2.38916100
          2.98576900          0.00408220          0.48297950         -0.16153150          0.46903910         -0.64064250          0.25916240          2.97771040
          1.33690200          0.00158570          0.39676170         -0.13642790         -0.03999370          0.74529540         -1.95908200         -1.23898700
          0.54996100         -0.00023230          0.09411040          0.11657870         -0.81822090          0.70157210          1.69317510         -0.86403040
          0.21998400          0.00019580         -0.00153060          0.54683600         -0.22067370         -1.15028400         -0.04944150          2.10218020
          0.08799400         -0.00008780          0.00254790          0.41490790          0.53820720         -0.05687820         -1.23518600         -2.15106500
          0.03519800          0.00002740         -0.00067970          0.07954380          0.36284880          0.84283010          1.00611850          1.08537290
  1  2  2 10  5
        305.01150000          0.00102500         -0.00138600          0.00152390         -0.00179460          0.00178500
         91.40003000          0.00884670         -0.01201630          0.01363620         -0.01752960          0.02611880
         34.95829000          0.04068310         -0.05596400          0.06257500         -0.07605900          0.08325370
         14.83697000          0.12323990         -0.17605410          0.21698560         -0.30775460          0.52970350
          6.68074800          0.24793300         -0.34913890          0.40159130         -0.40478260         -0.04624890
          3.02902600          0.33086680         -0.27309330         -0.16958970          0.86315710         -1.22731000
          1.33483900          0.31736350          0.21104720         -0.70399180          0.12409940          1.44555740
          0.55860800          0.22301480          0.51804310          0.13084190         -0.93622630         -0.44625940
          0.21174300          0.08092210          0.26108130          0.59401250          0.39627950         -0.72163950
          0.08469700          0.00354320          0.02024490          0.18018630          0.51834500          0.92500470
  1  3  3  6  3
         16.57440000          0.04557150         -0.09412220          0.18733420
          6.56950000          0.21536030         -0.43664550          0.65450530
          2.60390000          0.46964770         -0.37405330         -0.44338020
          1.03210000          0.40406900          0.42861550         -0.54524920
          0.40910000          0.16303650          0.47241450          0.66776630
          0.16210000          0.02361610          0.09871230          0.24004600
  1  4  4  4  2
          9.37400000         -0.09254470          0.42041750
          3.68440000         -0.47648320          0.55152460
          1.44820000         -0.50522730         -0.42970440
          0.56920000         -0.19574530         -0.47388660
# BASIS="NASA Ames cc-pVTZ"
#C.W. Bauschlicher, Jr., Theor. Chem. Acc. 103, 141 (1999)
#C.W. Bauschlicher, Jr., Theor. Chim Acta 92, 183 (1995)
#A. Ricca and C. W. Bauschlicher, Jr. Theor. Chem. Acc. 106, 314 (2001)
#
# TITANIUM    (21s,16p,9d,2f,1g) -> [7s,8p,6d,2f,1g]
TI NASA-Ames-cc-pVTZ
 21
  1  0  0 17  3
    5309148.10000000          0.00000400         -0.00000100          0.00000000
     794951.65000000          0.00003400         -0.00001000          0.00000400
     180907.56000000          0.00018000         -0.00005300          0.00001800
      51241.93300000          0.00075900         -0.00022400          0.00008100
      16717.44900000          0.00275700         -0.00081800          0.00028900
       6035.26590000          0.00892500         -0.00265900          0.00095100
       2353.85710000          0.02606200         -0.00787900          0.00281200
        976.14646000          0.06819000         -0.02122200          0.00760200
        425.43563000          0.15434900         -0.05142200          0.01859200
        193.04677000          0.28028200         -0.10670200          0.03908500
         90.43936900          0.34840000         -0.17468600          0.06649800
         43.02071300          0.22170500         -0.15604100          0.06204600
         19.19055500          0.04001800          0.12932300         -0.05624900
          9.42571600         -0.00213800          0.53846400         -0.31808900
          4.60524300          0.00172200          0.43570800         -0.40582700
          2.03783400         -0.00080200          0.06811700          0.17043200
          0.98003200          0.00035600         -0.00243600          0.69759600
  1  0  0  1  1
          0.44562500          1.00000000
  1  0  0  1  1
          0.10641700          1.00000000
  1  0  0  1  1
          0.05257100          1.00000000
  1  0  0  1  1
          0.02435700          1.00000000
  1  1  1 10  2
       7999.80450000          0.00008800         -0.00002900
       1894.45150000          0.00077700         -0.00026100
        615.18748000          0.00440400         -0.00148200
        234.92741000          0.01866400         -0.00635700
         99.21375300          0.06207200         -0.02147700
         44.91614000          0.15907700         -0.05713400
         21.24971700          0.29697000         -0.11046600
         10.33045800          0.36880100         -0.14814700
          5.10498000          0.23482600         -0.05542600
          2.44069000          0.04935600          0.24556200
  1  1  1  1  1
          1.15120500          1.00000000
  1  1  1  1  1
          0.52955600          1.00000000
  1  1  1  1  1
          0.22119000          1.00000000
  1  1  1  1  1
          0.08800000          1.00000000
  1  1  1  1  1
          0.03500000          1.00000000
  1  1  1  1  1
          0.01400000          1.00000000
  1  2  2  4  1
         89.56920100          0.00196600
         26.58435600          0.01471900
          9.77103200          0.05820800
          3.96193300          0.15816800
  1  2  2  1  1
          1.68926900          1.00000000
  1  2  2  1  1
          0.71567100          1.00000000
  1  2  2  1  1
          0.29381100          1.00000000
  1  2  2  1  1
          0.11083100          1.00000000
  1  2  2  1  1
          0.04400000          1.00000000
  1  3  3  1  1
          1.27522000          1.00000000
  1  3  3  1  1
          0.29275000          1.00000000
  1  4  4  1  1
          0.63000000          1.00000000
# IRON        (20s,15p,10d,2f,1g) -> [6s,8p,6d,2f,1g]
FE NASA-Ames-cc-pVTZ
 19
  1  0  0 18  4
    4316265.30000000          0.00000900         -0.00000300          0.00000100          0.00000000
     646342.42000000          0.00006700         -0.00002000          0.00000800          0.00000200
     147089.73000000          0.00035400         -0.00010800          0.00004000          0.00000900
      41661.52200000          0.00149400         -0.00045400          0.00016800          0.00003600
      13590.76500000          0.00541100         -0.00165000          0.00061100          0.00013100
       4905.75000000          0.01735300         -0.00534200          0.00198400          0.00042500
       1912.74580000          0.04954000         -0.01561900          0.00580600          0.00124200
        792.60434000          0.12303400         -0.04088800          0.01532800          0.00328400
        344.80648000          0.24929100         -0.09290700          0.03521000          0.00755300
        155.89989000          0.35856000         -0.16893700          0.06622500          0.01427200
         72.23090800          0.27747900         -0.19099100          0.07845200          0.01699600
         32.72506500          0.06720100          0.04396800         -0.01878600         -0.00403800
         15.66762200         -0.00115500          0.51545300         -0.30518700         -0.06963000
          7.50348300          0.00193100          0.50516300         -0.45933800         -0.11009600
          3.31222300         -0.00089300          0.09237500          0.12705800          0.03847200
          1.55847100          0.00038500         -0.00240300          0.72923500          0.22624000
          0.68391400         -0.00015100          0.00224600          0.39926300          0.25066100
          0.14675700          0.00005600         -0.00049400          0.01649000         -0.31982700
  1  0  0  1  1
          0.07058300          1.00000000
  1  0  0  1  1
          0.03144900          1.00000000
  1  1  1  9  2
       7721.48860000          0.00017600         -0.00006400
       1829.12580000          0.00155100         -0.00056200
        593.62795000          0.00863900         -0.00315600
        226.20536000          0.03548200         -0.01310900
         95.26145400          0.11080500         -0.04228300
         42.85920300          0.25153600         -0.09985100
         20.04971300          0.38166900         -0.16204600
          9.62088500          0.30991000         -0.11496300
          4.54137100          0.08786400          0.18174200
  1  1  1  1  1
          2.11350000          1.00000000
  1  1  1  1  1
          0.94720100          1.00000000
  1  1  1  1  1
          0.39124300          1.00000000
  1  1  1  1  1
          0.15648000          1.00000000
  1  1  1  1  1
          0.06259200          1.00000000
  1  1  1  1  1
          0.02503700          1.00000000
  1  2  2  5  1
        217.36883000          0.00094500
         64.99975500          0.00806000
         24.77313700          0.03650400
         10.43614000          0.11103400
          4.67965300          0.23254500
  1  2  2  1  1
          2.12562300          1.00000000
  1  2  2  1  1
          0.94524200          1.00000000
  1  2  2  1  1
          0.40268500          1.00000000
  1  2  2  1  1
          0.15665100          1.00000000
  1  2  2  1  1
          0.06266000          1.00000000
  1  3  3  1  1
          3.26595300          1.00000000
  1  3  3  1  1
          0.78678700          1.00000000
  1  4  4  1  1
          2.24800000          1.00000000
#  Def2-QZVP  EMSL  Basis Set Exchange Library  11/25/09 4:23 AM
# Elements                             References
# --------                             ----------
# H He Li Be B C N O F Ne Na Mg Al Si P S Cl Ar K Ca Sc Ti V Cr Mn Fe Co Ni Cu Zn Ga Ge As Se Br Kr Rb Sr Y Zr Nb Mo Tc Ru Rh Pd Ag Cd In Sn Sb Te I Xe Cs Ba La Hf Ta W Re Os Ir Pt Au Hg Tl Pb Bi Po At Rn : F. Weigend and R. Ahlrichs, Phys. Chem. Chem. Phy
# quality for H to Rn: Design and assessment of accuracy 7, 3297 (2005).
#
# HYDROGEN
H  Ahlrichs-def2-QZVP
 10
  1  0  0  4  1
        190.69169000          0.00070815
         28.60553200          0.00546788
          6.50959430          0.02796660
          1.84124550          0.10764538
  1  0  0  1  1
          0.59853725          1.00000000
  1  0  0  1  1
          0.21397624          1.00000000
  1  0  0  1  1
          0.08031629          1.00000000
  1  1  1  1  1
          2.29200000          1.00000000
  1  1  1  1  1
          0.83800000          1.00000000
  1  1  1  1  1
          0.29200000          1.00000000
  1  2  2  1  1
          2.06200000          1.00000000
  1  2  2  1  1
          0.66200000          1.00000000
  1  3  3  1  1
          1.39700000          1.00000000
# HELIUM
He Ahlrichs-def2-QZVP
 10
  1  0  0  5  1
       1144.64708090          0.00035862
        171.64596667          0.00277254
         39.06605625          0.01424189
         11.05140199          0.05545735
          3.57255745          0.16170512
  1  0  0  1  1
          1.24294160          1.00000000
  1  0  0  1  1
          0.44807669          1.00000000
  1  0  0  1  1
          0.16411579          1.00000000
  1  1  1  1  1
          5.99400000          1.00000000
  1  1  1  1  1
          1.74500000          1.00000000
  1  1  1  1  1
          0.56000000          1.00000000
  1  2  2  1  1
          4.29900000          1.00000000
  1  2  2  1  1
          1.22300000          1.00000000
  1  3  3  1  1
          2.68000000          1.00000000
# LITHIUM
Li Ahlrichs-def2-QZVP
 13
  1  0  0  9  1
      14853.97708500          0.00004271
       2225.22364770          0.00033235
        504.88739008          0.00175184
        142.45847548          0.00734780
         46.31559958          0.02589984
         16.65533547          0.07667068
          6.43311862          0.18276076
          2.60270439          0.32655434
          1.08972454          0.37000430
  1  0  0  2  1
          4.42365960          0.11120988
          1.23563950          0.79987336
  1  0  0  1  1
          0.46067471          1.00000000
  1  0  0  1  1
          0.09661717          1.00000000
  1  0  0  1  1
          0.04591545          1.00000000
  1  0  0  1  1
          0.02114005          1.00000000
  1  1  1  3  1
          3.26051092          0.00865047
          0.65003043          0.04761412
          0.16941671          0.21001138
  1  1  1  1  1
          0.05573234          1.00000000
  1  1  1  1  1
          0.02048996          1.00000000
  1  1  1  1  1
          3.32700000          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
  1  2  2  1  1
          0.07570000          1.00000000
  1  3  3  1  1
          0.13500000          1.00000000
# BERYLLIUM
Be Ahlrichs-def2-QZVP
 14
  1  0  0  8  1
      29646.70440700          0.00003794
       4428.76143540          0.00029605
       1005.47013320          0.00155725
        284.15339578          0.00653232
         92.50435646          0.02311686
         33.31101606          0.06945852
         12.91155331          0.17014371
          5.26654974          0.31682711
  1  0  0  2  1
         22.99538638          0.08179112
          6.62363542          0.80000038
  1  0  0  1  1
          2.22895950          1.00000000
  1  0  0  1  1
          0.95302433          1.00000000
  1  0  0  1  1
          0.24651602          1.00000000
  1  0  0  1  1
          0.10153895          1.00000000
  1  0  0  1  1
          0.04155137          1.00000000
  1  1  1  4  1
         14.09978945          0.00385089
          3.18031885          0.02415238
          0.90489220          0.09792693
          0.30411586          0.29470380
  1  1  1  1  1
          0.11302607          1.00000000
  1  1  1  1  1
          0.04283173          1.00000000
  1  1  1  1  1
          6.40000000          1.00000000
  1  2  2  1  1
          0.36000000          1.00000000
  1  2  2  1  1
          0.09000000          1.00000000
  1  3  3  1  1
          0.29000000          1.00000000
# BORON
B  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
      46447.66705600          0.00003839
       6957.68890420          0.00029837
       1583.44284030          0.00156455
        448.46601009          0.00654768
        146.28639262          0.02313901
         52.78438608          0.06961580
         20.51939617          0.17119637
          8.41856593          0.31913192
  1  0  0  2  1
         36.51001831          0.07899062
         10.54185400          0.78926384
  1  0  0  1  1
          3.60040914          1.00000000
  1  0  0  1  1
          1.56170237          1.00000000
  1  0  0  1  1
          0.44997371          1.00000000
  1  0  0  1  1
          0.18075230          1.00000000
  1  0  0  1  1
          0.07159670          1.00000000
  1  1  1  5  1
         72.24046276          0.00086539
         16.80770721          0.00687621
          5.22594107          0.03097669
          1.85083507          0.10432358
          0.72206783          0.26164138
  1  1  1  1  1
          0.29491018          1.00000000
  1  1  1  1  1
          0.12201142          1.00000000
  1  1  1  1  1
          0.04986539          1.00000000
  1  2  2  1  1
          1.11000000          1.00000000
  1  2  2  1  1
          0.40200000          1.00000000
  1  2  2  1  1
          0.14500000          1.00000000
  1  3  3  1  1
          0.88200000          1.00000000
  1  3  3  1  1
          0.31100000          1.00000000
  1  4  4  1  1
          0.67300000          1.00000000
# CARBON
C  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
      67025.07102900          0.00003874
      10039.98653800          0.00030108
       2284.93169110          0.00157879
        647.14122130          0.00660871
        211.09472335          0.02336712
         76.17764386          0.07042072
         29.63383916          0.17360345
         12.18778508          0.32292306
  1  0  0  2  1
         53.02600630          0.07489740
         15.25850278          0.76136221
  1  0  0  1  1
          5.24039575          1.00000000
  1  0  0  1  1
          2.29050224          1.00000000
  1  0  0  1  1
          0.69673283          1.00000000
  1  0  0  1  1
          0.27599337          1.00000000
  1  0  0  1  1
          0.10739884          1.00000000
  1  1  1  5  1
        105.12555082          0.00084648
         24.88446107          0.00662740
          7.86372308          0.03012039
          2.84070018          0.09995144
          1.12271373          0.23826299
  1  1  1  1  1
          0.46050726          1.00000000
  1  1  1  1  1
          0.18937531          1.00000000
  1  1  1  1  1
          0.07598379          1.00000000
  1  2  2  1  1
          1.84800000          1.00000000
  1  2  2  1  1
          0.64900000          1.00000000
  1  2  2  1  1
          0.22800000          1.00000000
  1  3  3  1  1
          1.41900000          1.00000000
  1  3  3  1  1
          0.48500000          1.00000000
  1  4  4  1  1
          1.01100000          1.00000000
# NITROGEN
N  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
      90726.88921000          0.00003926
      13590.52880100          0.00030513
       3092.98837810          0.00160006
        875.99876362          0.00669829
        285.74469982          0.02369008
        103.11913417          0.07145541
         40.12855678          0.17632775
         16.52809570          0.32677593
  1  0  0  2  1
         69.39096098          0.08005209
         20.42820060          0.78268064
  1  0  0  1  1
          7.12925880          1.00000000
  1  0  0  1  1
          3.13243049          1.00000000
  1  0  0  1  1
          0.98755779          1.00000000
  1  0  0  1  1
          0.38765721          1.00000000
  1  0  0  1  1
          0.14909883          1.00000000
  1  1  1  5  1
        150.05742670         -0.00086216
         35.49159948         -0.00685713
         11.24786422         -0.03179569
          4.09003052         -0.10537397
          1.62205731         -0.24519708
  1  1  1  1  1
          0.66442262          1.00000000
  1  1  1  1  1
          0.27099770          1.00000000
  1  1  1  1  1
          0.10688750          1.00000000
  1  2  2  1  1
          2.83700000          1.00000000
  1  2  2  1  1
          0.96800000          1.00000000
  1  2  2  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          2.02700000          1.00000000
  1  3  3  1  1
          0.68500000          1.00000000
  1  4  4  1  1
          1.42700000          1.00000000
# OXYGEN
O  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
     116506.46908000          0.00004038
      17504.34972400          0.00031255
       3993.45132300          0.00163415
       1133.00631860          0.00682832
        369.99569594          0.02412441
        133.62074349          0.07273021
         52.03564365          0.17934430
         21.46193931          0.33059589
  1  0  0  2  1
         89.83505125          0.09646865
         26.42801084          0.94117481
  1  0  0  1  1
          9.28228246          1.00000000
  1  0  0  1  1
          4.09477285          1.00000000
  1  0  0  1  1
          1.32553491          1.00000000
  1  0  0  1  1
          0.51877231          1.00000000
  1  0  0  1  1
          0.19772676          1.00000000
  1  1  1  5  1
        191.15255810          0.00251157
         45.23335674          0.02003924
         14.35346592          0.09360906
          5.24223718          0.30618127
          2.07924186          0.67810501
  1  1  1  1  1
          0.84282371          1.00000000
  1  1  1  1  1
          0.33617695          1.00000000
  1  1  1  1  1
          0.12863998          1.00000000
  1  2  2  1  1
          3.77500000          1.00000000
  1  2  2  1  1
          1.30000000          1.00000000
  1  2  2  1  1
          0.44400000          1.00000000
  1  3  3  1  1
          2.66600000          1.00000000
  1  3  3  1  1
          0.85900000          1.00000000
  1  4  4  1  1
          1.84600000          1.00000000
# FLUORINE
F  Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
     132535.97345000          0.00004739
      19758.11258800          0.00037070
       4485.19969470          0.00194508
       1273.81510200          0.00805733
        418.93831236          0.02799288
        152.55721985          0.08273512
         59.82152482          0.19854169
         24.81907693          0.34860632
  1  0  0  2  1
        100.74446673          0.10505069
         30.10372829          0.94068472
  1  0  0  1  1
         10.81428327          1.00000000
  1  0  0  1  1
          4.81728868          1.00000000
  1  0  0  1  1
          1.65593342          1.00000000
  1  0  0  1  1
          0.64893520          1.00000000
  1  0  0  1  1
          0.24778105          1.00000000
  1  1  1  5  1
        240.96654114          0.00303899
         57.02069978          0.02435774
         18.12695212          0.11442926
          6.64574046          0.37064660
          2.63757229          0.79791552
  1  1  1  1  1
          1.06382172          1.00000000
  1  1  1  1  1
          0.41932563          1.00000000
  1  1  1  1  1
          0.15747588          1.00000000
  1  2  2  1  1
          5.01400000          1.00000000
  1  2  2  1  1
          1.72500000          1.00000000
  1  2  2  1  1
          0.58600000          1.00000000
  1  3  3  1  1
          3.56200000          1.00000000
  1  3  3  1  1
          1.14800000          1.00000000
  1  4  4  1  1
          2.37600000          1.00000000
# NEON
Ne Ahlrichs-def2-QZVP
 17
  1  0  0  8  1
     160676.27955000          0.00004739
      23953.19503900          0.00037070
       5437.50637110          0.00194508
       1544.27410240          0.00805733
        507.88814269          0.02799288
        184.94847750          0.08273512
         72.52295204          0.19854169
         30.08871357          0.34860632
  1  0  0  2  1
        120.68434940          0.10400597
         36.07429486          0.91999989
  1  0  0  1  1
         13.05209121          1.00000000
  1  0  0  1  1
          5.79747834          1.00000000
  1  0  0  1  1
          2.04786269          1.00000000
  1  0  0  1  1
          0.80214572          1.00000000
  1  0  0  1  1
          0.30548672          1.00000000
  1  1  1  6  1
        498.43397466          0.00043118
        118.14109217          0.00362064
         38.03252973          0.01824534
         14.18373195          0.06513304
          5.78641907          0.16708915
          2.45996222          0.29268020
  1  1  1  1  1
          1.04219995          1.00000000
  1  1  1  1  1
          0.42987749          1.00000000
  1  1  1  1  1
          0.16889708          1.00000000
  1  2  2  1  1
          6.47100000          1.00000000
  1  2  2  1  1
          2.21300000          1.00000000
  1  2  2  1  1
          0.74700000          1.00000000
  1  3  3  1  1
          4.65700000          1.00000000
  1  3  3  1  1
          1.52400000          1.00000000
  1  4  4  1  1
          2.98300000          1.00000000
# SODIUM
Na Ahlrichs-def2-QZVP
 18
  1  0  0 10  1
     379852.20081000          0.00002067
      56886.00637800          0.00016070
      12942.70183800          0.00084463
       3664.30179040          0.00355190
       1194.74174990          0.01275403
        430.98192917          0.03989546
        167.83169424          0.10720154
         69.30666904          0.23339517
         29.95117089          0.36333077
         13.38079110          0.30544771
  1  0  0  3  1
        121.74011283          0.03614243
         37.04414339          0.28820962
         13.99542262          0.79337385
  1  0  0  1  1
          5.98277974          1.00000000
  1  0  0  1  1
          2.48304551          1.00000000
  1  0  0  1  1
          1.04525062          1.00000000
  1  0  0  1  1
          0.43875640          1.00000000
  1  0  0  1  1
          0.06559563          1.00000000
  1  0  0  1  1
          0.03056193          1.00000000
  1  0  0  1  1
          0.01550906          1.00000000
  1  1  1  8  1
        690.77627017          0.00037479
        163.82806121          0.00317754
         52.87646077          0.01633358
         19.81227049          0.05975490
          8.13203788          0.15879329
          3.49690684          0.29049363
          1.51172441          0.36368131
          0.64479295          0.28195867
  1  1  1  1  1
          0.26145823          1.00000000
  1  1  1  1  1
          0.11704726          1.00000000
  1  1  1  1  1
          0.04049475          1.00000000
  1  1  1  1  1
          0.01566671          1.00000000
  1  2  2  1  1
          2.90000000          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
  1  2  2  1  1
          0.07570000          1.00000000
  1  3  3  1  1
          0.13500000          1.00000000
# MAGNESIUM
Mg Ahlrichs-def2-QZVP
 19
  1  0  0 10  1
     605967.78753000          0.00001443
      90569.09469200          0.00011250
      20574.25284400          0.00059265
       5818.62848650          0.00249888
       1895.62960750          0.00902308
        683.45941021          0.02857992
        266.18219762          0.07906445
        110.11220010          0.18269338
         47.77704123          0.32157194
         21.54216615          0.35028259
  1  0  0  3  1
        174.12136378          0.02293111
         53.48497250          0.19151778
         20.50021331          0.61155711
  1  0  0  1  1
          9.80568269          1.00000000
  1  0  0  1  1
          3.54029893          1.00000000
  1  0  0  1  1
          1.54508500          1.00000000
  1  0  0  1  1
          0.66540195          1.00000000
  1  0  0  1  1
          0.14355439          1.00000000
  1  0  0  1  1
          0.06662467          1.00000000
  1  0  0  1  1
          0.02977265          1.00000000
  1  1  1  8  1
        893.20460829          0.00034958
        211.78258286          0.00298119
         68.44320054          0.01551785
         25.72726535          0.05757866
         10.60663428          0.15610308
          4.59341265          0.29230913
          2.01004698          0.37219024
          0.87384842          0.27578089
  1  1  1  1  1
          0.35615077          1.00000000
  1  1  1  1  1
          0.18995954          1.00000000
  1  1  1  1  1
          0.07458014          1.00000000
  1  1  1  1  1
          0.02922164          1.00000000
  1  2  2  1  1
          3.81000000          1.00000000
  1  2  2  1  1
          0.65000000          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  2  2  1  1
          0.05200000          1.00000000
  1  3  3  1  1
          0.16000000          1.00000000
# ALUMINUM
Al Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
     754550.78265000          0.00001342
     112999.38922000          0.00010433
      25715.83175900          0.00054842
       7283.60302830          0.00230891
       2376.00087960          0.00833100
        857.65468087          0.02641796
        334.38922598          0.07344365
        138.48504731          0.17184039
         60.15036881          0.31041980
         27.12761086          0.35669191
  1  0  0  3  1
        225.36500065          0.02152204
         69.34196812          0.18531780
         26.61933571          0.63533181
  1  0  0  1  1
         12.34942067          1.00000000
  1  0  0  1  1
          4.58787860          1.00000000
  1  0  0  1  1
          2.05713381          1.00000000
  1  0  0  1  1
          0.90864549          1.00000000
  1  0  0  1  1
          0.24226988          1.00000000
  1  0  0  1  1
          0.11248137          1.00000000
  1  0  0  1  1
          0.04815649          1.00000000
  1  1  1  8  1
       1489.61195220          0.00020177
        353.01399267          0.00175081
        114.40764069          0.00944247
         43.31218611          0.03686800
         18.02732222          0.10892874
          7.96754324          0.23265901
          3.60903995          0.34643587
          1.64560816          0.33440810
  1  1  1  2  1
         34.73118749          0.01782307
          1.25530836         -0.59991264
  1  1  1  1  1
          0.73635534          1.00000000
  1  1  1  1  1
          0.24686466          1.00000000
  1  1  1  1  1
          0.09482197          1.00000000
  1  1  1  1  1
          0.03621417          1.00000000
  1  2  2  1  1
          1.97000000          1.00000000
  1  2  2  1  1
          0.43700000          1.00000000
  1  2  2  1  1
          0.19500000          1.00000000
  1  2  2  1  1
          0.08000000          1.00000000
  1  3  3  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.40100000          1.00000000
  1  4  4  1  1
          0.35700000          1.00000000
# SILICON
Si Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
     918070.69565000          0.00001266
     137485.25386000          0.00009841
      31287.77271400          0.00051731
       8861.61056970          0.00217854
       2890.69431560          0.00786569
       1043.40639790          0.02498755
        406.80160276          0.06976182
        168.48360207          0.16473363
         73.18562882          0.30285603
         32.99848542          0.36007260
  1  0  0  3  1
        278.78751325          0.02018546
         85.91022872          0.17720407
         32.99260403          0.63587861
  1  0  0  1  1
         15.03369325          1.00000000
  1  0  0  1  1
          5.72575148          1.00000000
  1  0  0  1  1
          2.61465210          1.00000000
  1  0  0  1  1
          1.17578332          1.00000000
  1  0  0  1  1
          0.35432331          1.00000000
  1  0  0  1  1
          0.16248336          1.00000000
  1  0  0  1  1
          0.06833246          1.00000000
  1  1  1  8  1
       1775.88505160          0.00020187
        420.83786849          0.00175443
        136.42290243          0.00950395
         51.70099174          0.03732574
         21.55945600          0.11085396
          9.55592001          0.23756407
          4.35298195          0.35295784
          2.00969644          0.32885932
  1  1  1  2  1
         46.41815378          0.02585882
          1.90764178         -0.59874866
  1  1  1  1  1
          0.92337222          1.00000000
  1  1  1  1  1
          0.34515720          1.00000000
  1  1  1  1  1
          0.13656835          1.00000000
  1  1  1  1  1
          0.05298706          1.00000000
  1  2  2  1  1
          2.64500000          1.00000000
  1  2  2  1  1
          0.60800000          1.00000000
  1  2  2  1  1
          0.27200000          1.00000000
  1  2  2  1  1
          0.11300000          1.00000000
  1  3  3  1  1
          0.21200000          1.00000000
  1  3  3  1  1
          0.54100000          1.00000000
  1  4  4  1  1
          0.46100000          1.00000000
# PHOSPHOROUS
P  Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1090561.71380000          0.00001214
     163316.39461000          0.00009440
      37166.60745100          0.00049622
      10526.88094500          0.00209000
       3433.99760280          0.00754892
       1239.53604800          0.02401042
        483.27456199          0.06723147
        200.16911586          0.15978670
         86.96039483          0.29735907
         39.21128337          0.36187172
  1  0  0  3  1
        336.75883662          0.01915472
        103.72179793          0.17134079
         39.77186124          0.63689656
  1  0  0  1  1
         17.88861295          1.00000000
  1  0  0  1  1
          6.96445569          1.00000000
  1  0  0  1  1
          3.21980921          1.00000000
  1  0  0  1  1
          1.46699440          1.00000000
  1  0  0  1  1
          0.47765438          1.00000000
  1  0  0  1  1
          0.21637789          1.00000000
  1  0  0  1  1
          0.09023589          1.00000000
  1  1  1  8  1
       2019.67113740          0.00021359
        478.60125090          0.00185688
        155.14942504          0.01007069
         58.81635658          0.03960515
         24.54451278          0.11736068
         10.88357106          0.24950541
          4.96247913          0.36421288
          2.30029123          0.31764127
  1  1  1  2  1
         59.37134502          0.39432918
          3.06945910         -6.35229604
  1  1  1  1  1
          1.06344017          1.00000000
  1  1  1  1  1
          0.45022152          1.00000000
  1  1  1  1  1
          0.18267271          1.00000000
  1  1  1  1  1
          0.07161033          1.00000000
  1  2  2  1  1
          3.34300000          1.00000000
  1  2  2  1  1
          0.80700000          1.00000000
  1  2  2  1  1
          0.36500000          1.00000000
  1  2  2  1  1
          0.15400000          1.00000000
  1  3  3  1  1
          0.28000000          1.00000000
  1  3  3  1  1
          0.70300000          1.00000000
  1  4  4  1  1
          0.59700000          1.00000000
# SULFUR
S  Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1273410.90230000          0.00001177
     190697.83007000          0.00009148
      43397.88533000          0.00048090
      12291.80967700          0.00202572
       4009.74208240          0.00731901
       1447.35310300          0.02330050
        564.30102913          0.06538621
        233.74506243          0.15614450
        101.56402814          0.29318564
         45.80590719          0.36287914
  1  0  0  3  1
        394.27281503          0.01875331
        121.72249591          0.16870727
         46.75412596          0.63806831
  1  0  0  1  1
         20.92300825          1.00000000
  1  0  0  1  1
          8.26855678          1.00000000
  1  0  0  1  1
          3.86293457          1.00000000
  1  0  0  1  1
          1.77946848          1.00000000
  1  0  0  1  1
          0.61064260          1.00000000
  1  0  0  1  1
          0.27412269          1.00000000
  1  0  0  1  1
          0.11325939          1.00000000
  1  1  1  8  1
       2189.89304590          0.00023913
        518.94596592          0.00207720
        168.19560151          0.01124242
         63.74528279          0.04406993
         26.59703308          0.12918779
         11.77425145          0.26910820
          5.35343790          0.37855929
          2.47019118          0.29692135
  1  1  1  2  1
         82.12028835         -0.03942032
          4.95235329          0.64048403
  1  1  1  1  1
          1.08282620          1.00000000
  1  1  1  1  1
          0.49271277          1.00000000
  1  1  1  1  1
          0.20483451          1.00000000
  1  1  1  1  1
          0.08074362          1.00000000
  1  2  2  1  1
          4.15900000          1.00000000
  1  2  2  1  1
          1.01900000          1.00000000
  1  2  2  1  1
          0.46400000          1.00000000
  1  2  2  1  1
          0.19400000          1.00000000
  1  3  3  1  1
          0.33500000          1.00000000
  1  3  3  1  1
          0.86900000          1.00000000
  1  4  4  1  1
          0.68300000          1.00000000
# CHLORINE
Cl Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1467459.00950000          0.00001148
     219756.16433000          0.00008923
      50010.77030100          0.00046911
      14164.82391800          0.00197624
       4620.74655250          0.00714199
       1667.89916350          0.02275322
        650.29199265          0.06395978
        269.38037376          0.15331059
        117.06752106          0.28986952
         52.81176684          0.36348071
  1  0  0  3  1
        461.42769988          0.01801946
        142.12665355          0.16489442
         54.43783877          0.63891588
  1  0  0  1  1
         24.16077022          1.00000000
  1  0  0  1  1
          9.70835403          1.00000000
  1  0  0  1  1
          4.56406967          1.00000000
  1  0  0  1  1
          2.11947448          1.00000000
  1  0  0  1  1
          0.75722365          1.00000000
  1  0  0  1  1
          0.33747225          1.00000000
  1  0  0  1  1
          0.13860775          1.00000000
  1  1  1  8  1
       2501.94578900          0.00024243
        592.88059285          0.00210800
        192.18089186          0.01143269
         72.87571049          0.04495670
         30.43635837          0.13197476
         13.49017890          0.27493639
          6.14780714          0.38347236
          2.84509448          0.28871944
  1  1  1  2  1
        105.39397936         -0.03431176
          6.73697385          0.64060819
  1  1  1  1  1
          1.24210958          1.00000000
  1  1  1  1  1
          0.55669714          1.00000000
  1  1  1  1  1
          0.23387801          1.00000000
  1  1  1  1  1
          0.09316449          1.00000000
  1  2  2  1  1
          5.19100000          1.00000000
  1  2  2  1  1
          1.27600000          1.00000000
  1  2  2  1  1
          0.58300000          1.00000000
  1  2  2  1  1
          0.24300000          1.00000000
  1  3  3  1  1
          0.42300000          1.00000000
  1  3  3  1  1
          1.08900000          1.00000000
  1  4  4  1  1
          0.82700000          1.00000000
# ARGON
Ar Ahlrichs-def2-QZVP
 22
  1  0  0 10  1
    1673421.94940000          0.00001125
     250601.75373000          0.00008743
      57030.91212000          0.00045962
      16153.30391500          0.00193639
       5269.41092880          0.00699940
       1902.03155410          0.02231207
        741.57677159          0.06280808
        307.20901906          0.15101141
        133.52786203          0.28713661
         60.25338129          0.36385490
  1  0  0  3  1
        522.02426206          0.01807132
        161.51290469          0.16449220
         62.12636943          0.63897335
  1  0  0  1  1
         27.59093001          1.00000000
  1  0  0  1  1
         11.17552888          1.00000000
  1  0  0  1  1
          5.29590651          1.00000000
  1  0  0  1  1
          2.47827989          1.00000000
  1  0  0  1  1
          0.91262095          1.00000000
  1  0  0  1  1
          0.40426068          1.00000000
  1  0  0  1  1
          0.16562886          1.00000000
  1  1  1  8  1
       2868.45045810          0.00024010
        679.71869590          0.00209048
        220.36758824          0.01136932
         83.62043973          0.04490198
         34.96432266          0.13237157
         15.52513178          0.27709278
          7.09929798          0.38613980
          3.30213366          0.28492925
  1  1  1  2  1
        128.78765667         -0.03050946
          8.43578680          0.64101621
  1  1  1  1  1
          1.46186619          1.00000000
  1  1  1  1  1
          0.64658010          1.00000000
  1  1  1  1  1
          0.27229296          1.00000000
  1  1  1  1  1
          0.10905182          1.00000000
  1  2  2  1  1
          6.31500000          1.00000000
  1  2  2  1  1
          1.56200000          1.00000000
  1  2  2  1  1
          0.71500000          1.00000000
  1  2  2  1  1
          0.29700000          1.00000000
  1  3  3  1  1
          0.54300000          1.00000000
  1  3  3  1  1
          1.32500000          1.00000000
  1  4  4  1  1
          1.00700000          1.00000000
# POTASSIUM
K  Ahlrichs-def2-QZVP
 22
  1  0  0 11  1
    2022075.13910000          0.00001014
     303044.65568000          0.00007878
      69013.93849000          0.00041381
      19559.24461500          0.00174276
       6383.89349010          0.00630041
       2305.35028580          0.02012535
        899.14418101          0.05696606
        372.59500133          0.13882654
        161.97635247          0.27132285
         73.08555385          0.36383621
         33.59564476          0.24724465
  1  0  0  4  1
        685.49855365          0.00443675
        211.66163373          0.04250272
         80.85140513          0.18467742
         35.10866724          0.29353174
  1  0  0  1  1
         14.40943728          1.00000000
  1  0  0  1  1
          6.86971473          1.00000000
  1  0  0  1  1
          3.21218837          1.00000000
  1  0  0  1  1
          1.26104844          1.00000000
  1  0  0  1  1
          0.61438946          1.00000000
  1  0  0  1  1
          0.27264371          1.00000000
  1  0  0  1  1
          0.07717301          1.00000000
  1  0  0  1  1
          0.04091840          1.00000000
  1  0  0  1  1
          0.01705576          1.00000000
  1  1  1  9  1
       3469.66497180          0.00021340
        822.02356107          0.00186378
        266.58406636          0.01021143
        101.28048161          0.04079960
         42.42949076          0.12257473
         18.91208391          0.26405834
          8.70177790          0.38227165
          4.08545676          0.29998812
          1.86672861          0.07800727
  1  1  1  5  1
         27.54463906         -0.00582230
          9.20988936         -0.02678753
          1.72328774          0.30666848
          0.77969304          0.66927944
          0.34379048          0.60376469
  1  1  1  1  1
          0.14346682          1.00000000
  1  1  1  1  1
          0.06800000          1.00000000
  1  1  1  1  1
          0.03200000          1.00000000
  1  1  1  1  1
          0.01530000          1.00000000
  1  2  2  1  1
          1.70000000          1.00000000
  1  2  2  1  1
          0.51000000          1.00000000
  1  2  2  1  1
          0.18000000          1.00000000
  1  2  2  1  1
          0.05400000          1.00000000
  1  3  3  1  1
          0.26700000          1.00000000
# CALCIUM
Ca Ahlrichs-def2-QZVP
 22
  1  0  0 11  1
    2433075.43040000          0.00000916
     364160.43015000          0.00007127
      82898.74763700          0.00037434
      23499.73054000          0.00157629
       7671.22459850          0.00570261
       2770.23306870          0.01825574
       1080.68075500          0.05190642
        448.04894531          0.12791239
        194.92007727          0.25586635
         88.03979334          0.36028678
         40.64569672          0.26838462
  1  0  0  4  1
        779.53331918         -0.01840301
        241.18856300         -0.17649441
         92.40386932         -0.77662800
         39.78609034         -1.33521554
  1  0  0  1  1
         18.19586428          1.00000000
  1  0  0  1  1
          8.33214571          1.00000000
  1  0  0  1  1
          3.91901962          1.00000000
  1  0  0  1  1
          1.66670995          1.00000000
  1  0  0  1  1
          0.80891085          1.00000000
  1  0  0  1  1
          0.36174200          1.00000000
  1  0  0  1  1
          0.08237987          1.00000000
  1  0  0  1  1
          0.04794786          1.00000000
  1  0  0  1  1
          0.02230811          1.00000000
  1  1  1  9  1
       4064.22327960          0.00019781
        962.91550624          0.00173075
        312.34501046          0.00952987
        118.76056036          0.03838746
         49.81615313          0.11679256
         22.25967940          0.25637225
         10.28609412          0.37986194
          4.86069824          0.30805761
          2.25256829          0.08575600
  1  1  1  5  1
         31.46755544         -0.00424415
         10.65758906         -0.01957943
          2.05055554          0.21237507
          0.94362089          0.46277871
          0.42709068          0.39177496
  1  1  1  1  1
          0.17788187          1.00000000
  1  1  1  1  1
          0.08600000          1.00000000
  1  1  1  1  1
          0.04150000          1.00000000
  1  1  1  1  1
          0.02000000          1.00000000
  1  2  2  3  1
         16.92401210          0.03554397
          4.46554033          0.18133698
          1.43475762          0.48002060
  1  2  2  1  1
          0.46552377          1.00000000
  1  2  2  1  1
          0.14097711          1.00000000
  1  2  2  1  1
          0.04146701          1.00000000
  1  3  3  1  1
          0.32100000          1.00000000
# SCANDIUM
Sc Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    2855231.12640000          0.00000849
     427433.34221000          0.00006600
      97233.21854500          0.00034741
      27496.22284600          0.00146941
       8948.73244090          0.00534107
       3221.03972920          0.01720065
       1252.05340770          0.04928707
        517.26093376          0.12273535
        224.33127242          0.24910184
        101.10551671          0.35884367
         46.68495786          0.27782811
  1  0  0  4  1
        947.75965484          0.00361230
        293.07262846          0.03561622
        111.70230657          0.16664064
         47.75621521          0.32531051
  1  0  0  1  1
         21.12198401          1.00000000
  1  0  0  1  1
          9.77659222          1.00000000
  1  0  0  1  1
          4.59826993          1.00000000
  1  0  0  1  1
          1.99284878          1.00000000
  1  0  0  1  1
          0.95939954          1.00000000
  1  0  0  1  1
          0.42566790          1.00000000
  1  0  0  1  1
          0.09813220          1.00000000
  1  0  0  1  1
          0.05689422          1.00000000
  1  0  0  1  1
          0.02536991          1.00000000
  1  1  1  9  1
       4611.46802420          0.00019181
       1092.46664580          0.00168019
        354.41923265          0.00927633
        134.83390286          0.03753720
         56.61087393          0.11493045
         25.33660552          0.25446811
         11.74131324          0.37993353
          5.56972686          0.30948776
          2.59499541          0.08697226
  1  1  1  5  1
         35.95119808         -0.00557804
         12.30102023         -0.02593383
          2.38765578          0.27489094
          1.10318236          0.59208047
          0.50008479          0.49113472
  1  1  1  1  1
          0.20796509          1.00000000
  1  1  1  1  1
          0.10100000          1.00000000
  1  1  1  1  1
          0.04800000          1.00000000
  1  1  1  1  1
          0.02300000          1.00000000
  1  2  2  5  1
         73.53117975          0.00225064
         21.76475964          0.01637761
          7.92337017          0.06333045
          3.18478898          0.17056209
          1.34277900          0.30119020
  1  2  2  1  1
          0.56149575          1.00000000
  1  2  2  1  1
          0.22764074          1.00000000
  1  2  2  1  1
          0.08521122          1.00000000
  1  2  2  1  1
          0.03500000          1.00000000
  1  3  3  1  1
          1.48100000          1.00000000
  1  3  3  1  1
          0.34500000          1.00000000
  1  3  3  1  1
          0.11000000          1.00000000
  1  4  4  1  1
          0.24700000          1.00000000
# TITANIUM
Ti Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    3070548.86510000          0.00000870
     460777.88643000          0.00006745
     104901.22889000          0.00035477
      29695.86119900          0.00149775
       9678.88926880          0.00543099
       3490.18779120          0.01743936
       1359.22176210          0.04983563
        562.42721208          0.12379634
        244.22296250          0.25057491
        110.16668710          0.35934609
         50.88190336          0.27594243
  1  0  0  4  1
        965.95430789          0.00417739
        299.27072059          0.04027715
        114.83772939          0.17898687
         49.47757895          0.31783044
  1  0  0  1  1
         22.98283998          1.00000000
  1  0  0  1  1
         10.51830504          1.00000000
  1  0  0  1  1
          4.97743906          1.00000000
  1  0  0  1  1
          2.13398468          1.00000000
  1  0  0  1  1
          1.03424573          1.00000000
  1  0  0  1  1
          0.46199775          1.00000000
  1  0  0  1  1
          0.10621264          1.00000000
  1  0  0  1  1
          0.05434035          1.00000000
  1  0  0  1  1
          0.02511022          1.00000000
  1  1  1  9  1
       5169.67554270          0.00018803
       1225.09616380          0.00164735
        397.60051934          0.00911046
        151.36154684          0.03698745
         63.61332177          0.11376330
         28.51456031          0.25345209
         13.24800330          0.38019403
          6.30488078          0.30989136
          2.94935258          0.08741894
  1  1  1  5  1
         40.73877221         -0.00732338
         14.06235846         -0.03428259
          2.74606810          0.35655009
          1.27136881          0.76112035
          0.57610016          0.62716743
  1  1  1  1  1
          0.23981821          1.00000000
  1  1  1  1  1
          0.11000000          1.00000000
  1  1  1  1  1
          0.05000000          1.00000000
  1  1  1  1  1
          0.02300000          1.00000000
  1  2  2  5  1
         89.58988007          0.00212230
         26.59141296          0.01591182
          9.77397157          0.06287524
          3.96250837          0.17144171
          1.68905327          0.30565507
  1  2  2  1  1
          0.71539771          1.00000000
  1  2  2  1  1
          0.29366678          1.00000000
  1  2  2  1  1
          0.11079095          1.00000000
  1  2  2  1  1
          0.04500000          1.00000000
  1  3  3  1  1
          2.09300000          1.00000000
  1  3  3  1  1
          0.56200000          1.00000000
  1  3  3  1  1
          0.19100000          1.00000000
  1  4  4  1  1
          0.63400000          1.00000000
# VANADIUM
V  Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    3360380.03820000          0.00000870
     502646.73178000          0.00006779
     114247.22867000          0.00035699
      32321.97263000          0.00150755
      10532.94727100          0.00546644
       3798.30044390          0.01754731
       1479.60947150          0.05010659
        612.57405507          0.12431296
        266.22103326          0.25117027
        120.21980126          0.35926016
         55.59118085          0.27505076
  1  0  0  4  1
       1082.47686350          0.00393268
        334.94462061          0.03829848
        128.31559026          0.17259909
         55.31158962          0.31287424
  1  0  0  1  1
         25.10838304          1.00000000
  1  0  0  1  1
         11.66755324          1.00000000
  1  0  0  1  1
          5.53720733          1.00000000
  1  0  0  1  1
          2.37810076          1.00000000
  1  0  0  1  1
          1.15069473          1.00000000
  1  0  0  1  1
          0.51283991          1.00000000
  1  0  0  1  1
          0.11625711          1.00000000
  1  0  0  1  1
          0.05827279          1.00000000
  1  0  0  1  1
          0.02666231          1.00000000
  1  1  1  9  1
       5782.80350050          0.00018345
       1369.93922820          0.00160952
        444.53147129          0.00892423
        169.25617556          0.03637518
         71.16873003          0.11246803
         31.93335837          0.25226108
         14.86533678          0.38039695
          7.09217401          0.31068797
          3.32811578          0.08814120
  1  1  1  5  1
         45.84290602         -0.00566614
         15.94033902         -0.02671898
          3.12571550          0.27354633
          1.44858676          0.57972883
          0.65577903          0.47601111
  1  1  1  1  1
          0.27311627          1.00000000
  1  1  1  1  1
          0.12200000          1.00000000
  1  1  1  1  1
          0.05500000          1.00000000
  1  1  1  1  1
          0.02500000          1.00000000
  1  2  2  5  1
        103.95047414          0.00210072
         30.90168866          0.01601524
         11.42032115          0.06412746
          4.65732723          0.17488906
          1.99636826          0.31003778
  1  2  2  1  1
          0.84967250          1.00000000
  1  2  2  1  1
          0.34953222          1.00000000
  1  2  2  1  1
          0.13165588          1.00000000
  1  2  2  1  1
          0.05200000          1.00000000
  1  3  3  1  1
          2.93300000          1.00000000
  1  3  3  1  1
          0.83100000          1.00000000
  1  3  3  1  1
          0.25700000          1.00000000
  1  4  4  1  1
          1.00900000          1.00000000
# CHROMIUM
Cr Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    3637838.68200000          0.00000877
     544864.46100000          0.00006817
     123997.55079000          0.00035845
      35116.73316600          0.00151170
      11455.70229800          0.00547319
       4135.99067120          0.01753943
       1613.25135810          0.05000487
        668.77932380          0.12393519
        291.01365155          0.25039606
        131.57328167          0.35870470
         60.92456793          0.27581149
  1  0  0  4  1
       1196.28996010          0.00773686
        369.76947592          0.07583784
        141.54426084          0.34435149
         60.99922876          0.63249298
  1  0  0  1  1
         27.59911336          1.00000000
  1  0  0  1  1
         12.88211206          1.00000000
  1  0  0  1  1
          6.12475137          1.00000000
  1  0  0  1  1
          2.63328953          1.00000000
  1  0  0  1  1
          1.27084823          1.00000000
  1  0  0  1  1
          0.56483576          1.00000000
  1  0  0  1  1
          0.12596809          1.00000000
  1  0  0  1  1
          0.06204561          1.00000000
  1  0  0  1  1
          0.02814431          1.00000000
  1  1  1  9  1
       6395.87817920          0.00018105
       1515.17015740          0.00158937
        491.70538681          0.00882587
        187.28416675          0.03606895
         78.80034644          0.11189650
         35.39629169          0.25202240
         16.50927888          0.38082266
          7.89473969          0.31035222
          3.71364145          0.08798031
  1  1  1  5  1
         51.25931253         -0.00605420
         17.93493252         -0.02876176
          3.52571742          0.29087768
          1.63391639          0.61267525
          0.73852414          0.50126035
  1  1  1  1  1
          0.30752368          1.00000000
  1  1  1  1  1
          0.13500000          1.00000000
  1  1  1  1  1
          0.05900000          1.00000000
  1  1  1  1  1
          0.02600000          1.00000000
  1  2  2  5  1
        118.24986288          0.00210128
         35.19393570          0.01621227
         13.05781602          0.06558185
          5.34856028          0.17849601
          2.30042337          0.31376763
  1  2  2  1  1
          0.98114328          1.00000000
  1  2  2  1  1
          0.40334183          1.00000000
  1  2  2  1  1
          0.15135590          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  3  3  1  1
          3.73300000          1.00000000
  1  3  3  1  1
          1.14700000          1.00000000
  1  3  3  1  1
          0.36600000          1.00000000
  1  4  4  1  1
          1.38200000          1.00000000
# MANGANESE
Mn Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    4289357.64410000          0.00000794
     636361.00285000          0.00006254
     143637.27569000          0.00033226
      40406.34543200          0.00141300
      13104.36341700          0.00515609
       4705.06642550          0.01665957
       1825.71254320          0.04790808
        753.33816229          0.11994904
        326.47253285          0.24550297
        147.10300670          0.35822740
         67.98722687          0.28295764
  1  0  0  4  1
       1300.72667170          0.00760252
        402.72027544          0.07436511
        154.38971348          0.33780475
         66.44338461          0.62779332
  1  0  0  1  1
         30.97531601          1.00000000
  1  0  0  1  1
         14.22298089          1.00000000
  1  0  0  1  1
          6.75982651          1.00000000
  1  0  0  1  1
          2.90870833          1.00000000
  1  0  0  1  1
          1.39665078          1.00000000
  1  0  0  1  1
          0.61792624          1.00000000
  1  0  0  1  1
          0.13439484          1.00000000
  1  0  0  1  1
          0.06519505          1.00000000
  1  0  0  1  1
          0.02941571          1.00000000
  1  1  1  9  1
       6483.26296580          0.00020480
       1556.71348590          0.00175258
        509.73925460          0.00957988
        195.28408089          0.03868136
         82.54254753          0.11832402
         37.21207673          0.26168460
         17.42580446          0.38400629
          8.36913770          0.29704167
          3.94090004          0.07826329
  1  1  1  5  1
         57.20274101         -0.00477491
         20.09093595         -0.02298973
          3.93575538          0.23197066
          1.81819840          0.48435204
          0.81881535          0.39159479
  1  1  1  1  1
          0.34038359          1.00000000
  1  1  1  1  1
          0.15000000          1.00000000
  1  1  1  1  1
          0.06300000          1.00000000
  1  1  1  1  1
          0.02700000          1.00000000
  1  2  2  6  1
        200.40254535          0.00089550
         59.89822577          0.00762576
         22.81057017          0.03452322
          9.58741421          0.10552677
          4.29337109          0.22575378
          1.95376184          0.32766534
  1  2  2  1  1
          0.87378874          1.00000000
  1  2  2  1  1
          0.37597749          1.00000000
  1  2  2  1  1
          0.14811548          1.00000000
  1  2  2  1  1
          0.06000000          1.00000000
  1  3  3  1  1
          4.35300000          1.00000000
  1  3  3  1  1
          1.32600000          1.00000000
  1  3  3  1  1
          0.40800000          1.00000000
  1  4  4  1  1
          1.75500000          1.00000000
# IRON
Fe Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    4313154.43380000          0.00000867
     645875.08253000          0.00006742
     146981.87698000          0.00035449
      41630.61504400          0.00149483
      13580.62010900          0.00541367
       4902.06206130          0.01736246
       1911.29008370          0.04956657
        791.99837852          0.12309090
        344.54799181          0.24936706
        155.78722730          0.35858415
         72.17938032          0.27738222
  1  0  0  4  1
       1417.91250910          0.00748716
        439.23184195          0.07333758
        168.51006820          0.33383144
         72.77626941          0.62022525
  1  0  0  1  1
         32.75296177          1.00000000
  1  0  0  1  1
         15.43433610          1.00000000
  1  0  0  1  1
          7.36393182          1.00000000
  1  0  0  1  1
          3.16988329          1.00000000
  1  0  0  1  1
          1.52437084          1.00000000
  1  0  0  1  1
          0.67496281          1.00000000
  1  0  0  1  1
          0.14718566          1.00000000
  1  0  0  1  1
          0.07008222          1.00000000
  1  0  0  1  1
          0.03120827          1.00000000
  1  1  1  9  1
       7709.05876270          0.00017711
       1826.46663230          0.00155601
        592.84368362          0.00866295
        225.93763245          0.03556595
         95.16475889          0.11098847
         42.82313238          0.25177797
         20.03628658          0.38166911
          9.61593463          0.30963598
          4.53935388          0.08755828
  1  1  1  5  1
         62.99751900         -0.00509104
         22.26274873         -0.02454046
          4.39000649          0.24345605
          2.03289139          0.50781898
          0.91592622          0.41214896
  1  1  1  1  1
          0.38036654          1.00000000
  1  1  1  1  1
          0.16000000          1.00000000
  1  1  1  1  1
          0.06700000          1.00000000
  1  1  1  1  1
          0.02800000          1.00000000
  1  2  2  6  1
        218.33430163          0.00093700
         65.25629262          0.00800088
         24.86694482          0.03630529
         10.47339930          0.11057190
          4.69470050          0.23219589
          2.13159825          0.32922860
  1  2  2  1  1
          0.94748005          1.00000000
  1  2  2  1  1
          0.40346489          1.00000000
  1  2  2  1  1
          0.15687415          1.00000000
  1  2  2  1  1
          0.06200000          1.00000000
  1  3  3  1  1
          5.10300000          1.00000000
  1  3  3  1  1
          1.59800000          1.00000000
  1  3  3  1  1
          0.50500000          1.00000000
  1  4  4  1  1
          2.12800000          1.00000000
# COBALT
Co Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    4658206.50320000          0.00000866
     697560.87453000          0.00006734
     158759.87124000          0.00035399
      44969.09937900          0.00149264
      14670.71424700          0.00540531
       5295.89472500          0.01733523
       2065.05811670          0.04948664
        855.90627750          0.12289352
        372.48747255          0.24903230
        168.50576608          0.35838320
         78.12876157          0.27777974
  1  0  0  4  1
       1534.51498850          0.00744644
        475.52976096          0.07299360
        182.54836839          0.33243105
         78.91646718          0.61900490
  1  0  0  1  1
         35.50086552          1.00000000
  1  0  0  1  1
         16.79041449          1.00000000
  1  0  0  1  1
          8.02402325          1.00000000
  1  0  0  1  1
          3.45716830          1.00000000
  1  0  0  1  1
          1.65998354          1.00000000
  1  0  0  1  1
          0.73380022          1.00000000
  1  0  0  1  1
          0.15878613          1.00000000
  1  0  0  1  1
          0.07453566          1.00000000
  1  0  0  1  1
          0.03286735          1.00000000
  1  1  1  9  1
       8425.43313520          0.00017492
       1995.87584520          0.00153789
        647.76765681          0.00857525
        246.88261214          0.03529527
        104.00952246          0.11050008
         46.82747814          0.25160925
         21.93444454          0.38209003
         10.54049953          0.30947120
          4.98204194          0.08743687
  1  1  1  5  1
         69.27078713         -0.00611724
         24.58397794         -0.02965504
          4.85622589          0.29163333
          2.24809161          0.60629408
          1.01142860          0.49057440
  1  1  1  1  1
          0.41919905          1.00000000
  1  1  1  1  1
          0.17500000          1.00000000
  1  1  1  1  1
          0.07300000          1.00000000
  1  1  1  1  1
          0.03000000          1.00000000
  1  2  2  6  1
        237.58450966          0.00097593
         71.08689630          0.00834326
         27.11908068          0.03795847
         11.44823905          0.11522936
          5.13918067          0.23843468
          2.33234921          0.33205700
  1  2  2  1  1
          1.03386621          1.00000000
  1  2  2  1  1
          0.43785146          1.00000000
  1  2  2  1  1
          0.16895005          1.00000000
  1  2  2  1  1
          0.06600000          1.00000000
  1  3  3  1  1
          5.97500000          1.00000000
  1  3  3  1  1
          1.90300000          1.00000000
  1  3  3  1  1
          0.59400000          1.00000000
  1  4  4  1  1
          2.50000000          1.00000000
# NICKEL
Ni Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    5037649.95320000          0.00000861
     754246.39418000          0.00006694
     171644.16010000          0.00035191
      48617.23028600          0.00148391
      15860.96179500          0.00537363
       5726.00186530          0.01723338
       2232.95473170          0.04921148
        925.49649101          0.12232505
        402.75336913          0.24829252
        182.19422856          0.35825476
         84.49410979          0.27881866
  1  0  0  4  1
       1678.05645860          0.00824629
        519.21358326          0.08150594
        198.95881607          0.37495728
         85.90118070          0.70841744
  1  0  0  1  1
         38.43576012          1.00000000
  1  0  0  1  1
         18.25234935          1.00000000
  1  0  0  1  1
          8.72836169          1.00000000
  1  0  0  1  1
          3.76162457          1.00000000
  1  0  0  1  1
          1.80282173          1.00000000
  1  0  0  1  1
          0.79507141          1.00000000
  1  0  0  1  1
          0.17031720          1.00000000
  1  0  0  1  1
          0.07897124          1.00000000
  1  0  0  1  1
          0.03450349          1.00000000
  1  1  1  9  1
       9156.57014530          0.00017346
       2169.02395260          0.00152572
        703.98918991          0.00851633
        268.36293215          0.03511747
        113.10288796          0.11020275
         50.95553922          0.25162602
         23.89670821          0.38246390
         11.49824152          0.30907230
          5.44109081          0.08719438
  1  1  1  5  1
         75.93856074         -0.00746355
         27.03735018         -0.03645340
          5.34046874          0.35633549
          2.47001814          0.73774122
          1.10950291          0.59439383
  1  1  1  1  1
          0.45899767          1.00000000
  1  1  1  1  1
          0.18700000          1.00000000
  1  1  1  1  1
          0.07620000          1.00000000
  1  1  1  1  1
          0.03100000          1.00000000
  1  2  2  6  1
        258.11131142          0.00237263
         77.25489137          0.02033013
         29.50024003          0.09274849
         12.47744695          0.28082285
          5.60704551          0.57392658
          2.54277442          0.78766059
  1  2  2  1  1
          1.12382968          1.00000000
  1  2  2  1  1
          0.47361171          1.00000000
  1  2  2  1  1
          0.18161858          1.00000000
  1  2  2  1  1
          0.07100000          1.00000000
  1  3  3  1  1
          6.75800000          1.00000000
  1  3  3  1  1
          2.17400000          1.00000000
  1  3  3  1  1
          0.68100000          1.00000000
  1  4  4  1  1
          2.87200000          1.00000000
# COPPER
Cu Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    5056467.88980000          0.00000935
     759457.83835000          0.00007232
     173524.88497000          0.00037814
      49327.25998800          0.00158701
      16144.14993000          0.00572207
       5844.59646800          0.01826839
       2284.68127390          0.05189372
        948.88232514          0.12796192
        413.66215455          0.25629891
        187.38942059          0.36064416
         86.87277165          0.26833665
  1  0  0  4  1
       1744.05982870          0.00885871
        540.93295513          0.08652279
        207.99736224          0.38932285
         90.47579304          0.69777200
  1  0  0  1  1
         38.86968770          1.00000000
  1  0  0  1  1
         18.97482915          1.00000000
  1  0  0  1  1
          9.09536446          1.00000000
  1  0  0  1  1
          3.83300202          1.00000000
  1  0  0  1  1
          1.81988915          1.00000000
  1  0  0  1  1
          0.79068098          1.00000000
  1  0  0  1  1
          0.14914142          1.00000000
  1  0  0  1  1
          0.07244809          1.00000000
  1  0  0  1  1
          0.03095993          1.00000000
  1  1  1  9  1
       9720.46145550          0.00017829
       2302.75574520          0.00156781
        747.48498314          0.00874701
        285.00132623          0.03604455
        120.15121609          0.11287209
         54.14526116          0.25647377
         25.40603356          0.38512918
         12.22433147          0.30316512
          5.76387207          0.08167722
  1  1  1  5  1
         83.21083722         -0.00635304
         29.69477913         -0.03138383
          5.82485162          0.30930040
          2.67461812          0.63583926
          1.18418368          0.50946046
  1  1  1  1  1
          0.48043584          1.00000000
  1  1  1  1  1
          0.18700000          1.00000000
  1  1  1  1  1
          0.07620000          1.00000000
  1  1  1  1  1
          0.03100000          1.00000000
  1  2  2  6  1
        249.54025080          0.00124329
         74.68391453          0.01045690
         28.39271712          0.04645124
         11.95596843          0.13541360
          5.32107446          0.25852900
          2.36611895          0.33168128
  1  2  2  1  1
          1.01318640          1.00000000
  1  2  2  1  1
          0.40710036          1.00000000
  1  2  2  1  1
          0.14742541          1.00000000
  1  2  2  1  1
          0.07100000          1.00000000
  1  3  3  1  1
          6.96200000          1.00000000
  1  3  3  1  1
          2.23300000          1.00000000
  1  3  3  1  1
          0.70400000          1.00000000
  1  4  4  1  1
          3.24500000          1.00000000
# ZINC
Zn Ahlrichs-def2-QZVP
 26
  1  0  0 11  1
    5742307.15070000          0.00000869
     861450.78790000          0.00006736
     196346.05866000          0.00035350
      55682.87073700          0.00148842
      18183.90239400          0.00538409
       6569.64480190          0.01725274
       2563.56132760          0.04923868
       1063.11471760          0.12235812
        462.89771078          0.24835390
        209.52821049          0.35830633
         97.24078799          0.27880260
  1  0  0  4  1
       1929.26899920          0.00830770
        598.07122307          0.08188259
        229.69667336          0.37588060
         99.41681923          0.71067260
  1  0  0  1  1
         44.24110142          1.00000000
  1  0  0  1  1
         21.19436711          1.00000000
  1  0  0  1  1
         10.15873160          1.00000000
  1  0  0  1  1
          4.37461762          1.00000000
  1  0  0  1  1
          2.09014891          1.00000000
  1  0  0  1  1
          0.91869136          1.00000000
  1  0  0  1  1
          0.19278661          1.00000000
  1  0  0  1  1
          0.08732992          1.00000000
  1  0  0  1  1
          0.03755222          1.00000000
  1  1  1  9  1
      10690.44510700          0.00017143
       2532.31593400          0.00150880
        821.94295003          0.00843688
        313.42757800          0.03489810
        132.18314247          0.10993617
         59.62055439          0.25207277
         28.01948887          0.38325658
         13.51170485          0.30787091
          6.40537113          0.08641170
  1  1  1  5  1
         89.98113192         -0.00962628
         32.24176711         -0.04750941
          6.38094486          0.45834100
          2.94779284          0.94473799
          1.32008550          0.75923465
  1  1  1  1  1
          0.54424674          1.00000000
  1  1  1  1  1
          0.25799972          1.00000000
  1  1  1  1  1
          0.09286319          1.00000000
  1  1  1  1  1
          0.03405934          1.00000000
  1  2  2  6  1
        305.22298937          0.00273598
         91.46827320          0.02358523
         34.98698597          0.10858422
         14.84941519          0.32843594
          6.68585457          0.66180236
          3.03094126          0.89165339
  1  2  2  1  1
          1.33550507          1.00000000
  1  2  2  1  1
          0.55883176          1.00000000
  1  2  2  1  1
          0.21180799          1.00000000
  1  2  2  1  1
          0.08300000          1.00000000
  1  3  3  1  1
          8.02000000          1.00000000
  1  3  3  1  1
          2.61400000          1.00000000
  1  3  3  1  1
          0.83600000          1.00000000
  1  4  4  1  1
          3.61700000          1.00000000
# GALLIUM
Ga Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    6623802.02740000          0.00000791
     987904.07075000          0.00006184
     224132.05899000          0.00032636
      63315.19294300          0.00138104
      20611.31270200          0.00501538
       7429.16724820          0.01613094
       2894.20717200          0.04624083
       1198.99157860          0.11579100
        521.82003812          0.23834841
        236.27549237          0.35374256
        109.98395671          0.29055722
  1  0  0  4  1
       2101.25872530          0.00830396
        650.97022519          0.08225413
        250.22438356          0.38021717
        108.17616625          0.74503595
  1  0  0  1  1
         51.05748671          1.00000000
  1  0  0  1  1
         23.64747453          1.00000000
  1  0  0  1  1
         11.36170114          1.00000000
  1  0  0  1  1
          5.01781359          1.00000000
  1  0  0  1  1
          2.41026750          1.00000000
  1  0  0  1  1
          1.07410467          1.00000000
  1  0  0  1  1
          0.25745076          1.00000000
  1  0  0  1  1
          0.12175228          1.00000000
  1  0  0  1  1
          0.05236060          1.00000000
  1  1  1  9  1
      14711.75048300          0.00011131
       3482.14517160          0.00098496
       1130.21866550          0.00558542
        431.54093448          0.02368241
        182.41723648          0.07821159
         82.70675360          0.19503830
         39.22812877          0.34131988
         19.20197994          0.35718665
          9.50569667          0.16395955
  1  1  1  2  1
         92.61561302         -0.08584828
         33.75014816         -0.39435020
  1  1  1  4  1
          7.34822830          0.37941607
          3.78133848          0.71306292
          2.31451831          0.43210001
          0.80346860          0.25838123
  1  1  1  1  1
          1.54237101          1.00000000
  1  1  1  1  1
          0.32910240          1.00000000
  1  1  1  1  1
          0.11834089          1.00000000
  1  1  1  1  1
          0.04162788          1.00000000
  1  2  2  7  1
        363.49565218          0.00087402
        109.01749589          0.00767519
         41.86643071          0.03638898
         17.87927989          0.11325183
          8.12018937          0.23770881
          3.73606114          0.33306060
          1.68268125          0.33130614
  1  2  2  1  1
          0.72655790          1.00000000
  1  2  2  1  1
          0.28498585          1.00000000
  1  2  2  1  1
          0.11200000          1.00000000
  1  3  3  1  1
          0.18100000          1.00000000
  1  3  3  1  1
          0.47100000          1.00000000
  1  4  4  1  1
          0.40320000          1.00000000
# GERMANIUM
Ge Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    7233056.03460000          0.00000766
    1082886.17310000          0.00005960
     246481.46959000          0.00031319
      69862.42695500          0.00131941
      22815.80966200          0.00477361
       8246.53692970          0.01531925
       3219.93672570          0.04390087
       1336.57437060          0.11028574
        582.87737501          0.22912630
        264.59511360          0.34779259
        123.77823320          0.29968722
  1  0  0  4  1
       2311.10558040          0.00750331
        716.27089868          0.07477839
        275.45330910          0.35092882
        118.93292565          0.72055990
  1  0  0  1  1
         58.43569909          1.00000000
  1  0  0  1  1
         26.26157597          1.00000000
  1  0  0  1  1
         12.66488067          1.00000000
  1  0  0  1  1
          5.72695485          1.00000000
  1  0  0  1  1
          2.75550232          1.00000000
  1  0  0  1  1
          1.24328868          1.00000000
  1  0  0  1  1
          0.33107184          1.00000000
  1  0  0  1  1
          0.15964081          1.00000000
  1  0  0  1  1
          0.06846318          1.00000000
  1  1  1  9  1
      16555.71107400          0.00010199
       3914.99037450          0.00090504
       1269.47665180          0.00515585
        484.35437789          0.02201034
        204.64985822          0.07343480
         92.79103209          0.18608955
         44.05506026          0.33330982
         21.60131993          0.36229776
         10.73216923          0.17765186
  1  1  1  2  1
        100.88933962         -0.11146182
         36.64025474         -0.52324324
  1  1  1  4  1
          8.03432241          0.31484763
          4.56134383          0.38737745
          3.17948822          0.50034354
          0.92612041          0.22656708
  1  1  1  1  1
          1.79770409          1.00000000
  1  1  1  1  1
          0.41386865          1.00000000
  1  1  1  1  1
          0.15830799          1.00000000
  1  1  1  1  1
          0.05787704          1.00000000
  1  2  2  7  1
        420.99565921          0.00078212
        126.36209818          0.00695601
         48.66147355          0.03371219
         20.88032553          0.10717291
          9.54182294          0.23161030
          4.43536539          0.33390954
          2.02854219          0.33720676
  1  2  2  1  1
          0.89484935          1.00000000
  1  2  2  1  1
          0.35786074          1.00000000
  1  2  2  1  1
          0.14000000          1.00000000
  1  3  3  1  1
          0.54920000          1.00000000
  1  3  3  1  1
          0.21900000          1.00000000
  1  4  4  1  1
          0.46810000          1.00000000
# ARSENIC
As Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    8217482.61980000          0.00000706
    1230500.37200000          0.00005488
     280225.86648000          0.00028809
      79482.50941500          0.00121298
      25963.78335100          0.00439146
       9381.40101930          0.01412536
       3660.49119720          0.04065792
       1518.23560240          0.10300383
        661.80098920          0.21730077
        300.58642127          0.33995751
        141.11137296          0.31088634
  1  0  0  4  1
       2577.08705800          0.00707530
        798.07872277          0.07138362
        306.57574948          0.34287025
        132.27558802          0.74361403
  1  0  0  1  1
         67.44870223          1.00000000
  1  0  0  1  1
         29.20918044          1.00000000
  1  0  0  1  1
         14.15650933          1.00000000
  1  0  0  1  1
          6.55615067          1.00000000
  1  0  0  1  1
          3.13928472          1.00000000
  1  0  0  1  1
          1.42946310          1.00000000
  1  0  0  1  1
          0.41103391          1.00000000
  1  0  0  1  1
          0.20032453          1.00000000
  1  0  0  1  1
          0.08566993          1.00000000
  1  1  1 10  1
      25198.50427800          0.00005476
       5972.56013810          0.00048572
       1941.91231830          0.00279081
        743.59381104          0.01220151
        315.63828052          0.04266629
        143.96878925          0.11870919
         69.06868316          0.24909407
         34.25430563          0.36061357
         17.37174676          0.29392242
          8.76345556          0.09782906
  1  1  1  5  1
        228.49024582         -0.00249001
         86.31355549         -0.01948252
         36.75136627         -0.06149507
          8.53651495          0.47258065
          4.19351286          1.02360651
  1  1  1  1  1
          2.04649804          1.00000000
  1  1  1  1  1
          0.98000000          1.00000000
  1  1  1  1  1
          0.40534341          1.00000000
  1  1  1  1  1
          0.16655070          1.00000000
  1  1  1  1  1
          0.06598171          1.00000000
  1  2  2  7  1
        479.32599612          0.00071723
        143.96064855          0.00644192
         55.54890922          0.03177650
         23.92758101          0.10276249
         10.98819417          0.22710953
          5.14893563          0.33477474
          2.38368109          0.34175986
  1  2  2  1  1
          1.06882047          1.00000000
  1  2  2  1  1
          0.43305694          1.00000000
  1  2  2  1  1
          0.17000000          1.00000000
  1  3  3  1  1
          0.26400000          1.00000000
  1  3  3  1  1
          0.64400000          1.00000000
  1  4  4  1  1
          0.54650000          1.00000000
# SELENIUM
Se Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
    9520446.77430000          0.00000633
    1424984.08020000          0.00004927
     324127.57682000          0.00025920
      91774.87695000          0.00109431
      29932.72572500          0.00397061
      10804.61790500          0.01280119
       4214.01347790          0.03698038
       1747.81166330          0.09446135
        762.12160878          0.20274705
        346.45604141          0.32878956
        163.11569304          0.32300253
  1  0  0  4  1
       2614.51530670          0.00791139
        818.68552756          0.07718774
        318.63398991          0.35672062
        139.04844125          0.75846750
  1  0  0  1  1
         78.34873479          1.00000000
  1  0  0  1  1
         31.70429066          1.00000000
  1  0  0  1  1
         15.50585927          1.00000000
  1  0  0  1  1
          7.32274236          1.00000000
  1  0  0  1  1
          3.49694835          1.00000000
  1  0  0  1  1
          1.61215461          1.00000000
  1  0  0  1  1
          0.49587159          1.00000000
  1  0  0  1  1
          0.24092138          1.00000000
  1  0  0  1  1
          0.10231739          1.00000000
  1  1  1 10  1
      25360.21561500          0.00006053
       5993.78966100          0.00053988
       1943.07417550          0.00311305
        742.35316156          0.01359967
        314.62114597          0.04729896
        143.34748044          0.12981488
         68.67361755          0.26569982
         34.01355412          0.36723195
         17.19809962          0.27478356
          8.58303296          0.07925617
  1  1  1  5  1
        236.58209146         -0.00122716
         90.57618321         -0.00925846
         39.08668930         -0.02842873
          9.30843440          0.21201102
          4.61699231          0.47117590
  1  1  1  1  1
          2.26534775          1.00000000
  1  1  1  1  1
          1.08000000          1.00000000
  1  1  1  1  1
          0.47939329          1.00000000
  1  1  1  1  1
          0.19619984          1.00000000
  1  1  1  1  1
          0.07625634          1.00000000
  1  2  2  7  1
        539.48700124          0.00066723
        162.13394435          0.00603993
         62.66179564          0.03023867
         27.07727289          0.09926789
         12.48300393          0.22358036
          5.88646231          0.33574683
          2.75191311          0.34554856
  1  2  2  1  1
          1.25007696          1.00000000
  1  2  2  1  1
          0.51172842          1.00000000
  1  2  2  1  1
          0.20000000          1.00000000
  1  3  3  1  1
          0.28400000          1.00000000
  1  3  3  1  1
          0.70970000          1.00000000
  1  4  4  1  1
          0.57300000          1.00000000
# BROMINE
Br Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
   10629044.26400000          0.00000593
    1591918.27390000          0.00004612
     362333.98437000          0.00024245
     102643.11141000          0.00102314
      33489.84666800          0.00371220
      12091.24719000          0.01197811
       4716.19087890          0.03468269
       1956.15980800          0.08906833
        853.08595848          0.19330125
        387.96633666          0.32071145
        182.85156613          0.32996798
  1  0  0  4  1
       3240.40864210          0.00659052
       1000.46319350          0.06843961
        383.37301682          0.34495479
        166.03929698          0.82315542
  1  0  0  1  1
         87.91990699          1.00000000
  1  0  0  1  1
         35.67584007          1.00000000
  1  0  0  1  1
         17.54365784          1.00000000
  1  0  0  1  1
          8.44736604          1.00000000
  1  0  0  1  1
          3.96661806          1.00000000
  1  0  0  1  1
          1.83568160          1.00000000
  1  0  0  1  1
          0.59084779          1.00000000
  1  0  0  1  1
          0.28863218          1.00000000
  1  0  0  1  1
          0.12153381          1.00000000
  1  1  1 10  1
      26566.47657900          0.00006207
       6290.50885660          0.00055132
       2043.31784100          0.00316801
        781.67221007          0.01381660
        331.51078945          0.04801854
        151.09198667          0.13162015
         72.39527817          0.26860052
         35.86951084          0.36827391
         18.13990619          0.27108613
          9.04666889          0.07621534
  1  1  1  5  1
        253.71822146         -0.00137292
         97.25081806         -0.01039381
         42.03489796         -0.03220421
          9.96856736          0.24224770
          4.93958547          0.53557868
  1  1  1  1  1
          2.43828455          1.00000000
  1  1  1  1  1
          1.18000000          1.00000000
  1  1  1  1  1
          0.51047565          1.00000000
  1  1  1  1  1
          0.21215852          1.00000000
  1  1  1  1  1
          0.08394360          1.00000000
  1  2  2  7  1
        601.44434484          0.00062784
        180.85718640          0.00572052
         69.98680634          0.02900252
         30.32471030          0.09644699
         14.02790924          0.22065826
          6.65117021          0.33657642
          3.13541683          0.34872041
  1  2  2  1  1
          1.43935918          1.00000000
  1  2  2  1  1
          0.59350441          1.00000000
  1  2  2  1  1
          0.23000000          1.00000000
  1  3  3  1  1
          0.34070000          1.00000000
  1  3  3  1  1
          0.82570000          1.00000000
  1  4  4  1  1
          0.64910000          1.00000000
# KRYPTON
Kr Ahlrichs-def2-QZVP
 25
  1  0  0 11  1
   11713823.00800000          0.00000569
    1755253.39790000          0.00004421
     399717.41924000          0.00023228
     113285.79260000          0.00097974
      36977.20529300          0.00355376
      13355.03658000          0.01146867
       5210.90129880          0.03324163
       2162.11370200          0.08562073
        943.29291023          0.18708767
        429.20724331          0.31497583
        202.40720840          0.33406191
  1  0  0  4  1
       3260.49855210          0.00730915
       1011.10697160          0.07404036
        392.44359273          0.35414962
        173.21702132          0.80188286
  1  0  0  1  1
         96.61998847          1.00000000
  1  0  0  1  1
         38.15828487          1.00000000
  1  0  0  1  1
         18.95951757          1.00000000
  1  0  0  1  1
          9.25059962          1.00000000
  1  0  0  1  1
          4.34865176          1.00000000
  1  0  0  1  1
          2.03803242          1.00000000
  1  0  0  1  1
          0.69110153          1.00000000
  1  0  0  1  1
          0.33506065          1.00000000
  1  0  0  1  1
          0.14074441          1.00000000
  1  1  1 10  1
      28609.33576700          0.00006053
       6773.12363640          0.00053786
       2199.80110790          0.00309354
        841.50201590          0.01351432
        356.92110288          0.04709009
        162.71174351          0.12960370
         78.00426499          0.26607436
         38.68258000          0.36775851
         19.58915869          0.27406904
          9.79908634          0.07877335
  1  1  1  5  1
        261.37786869         -0.00163972
        100.09932146         -0.01203480
         44.01213936         -0.03489149
         10.85401074          0.25212651
          5.43519302          0.57400782
  1  1  1  1  1
          2.70628055          1.00000000
  1  1  1  1  1
          1.31956334          1.00000000
  1  1  1  1  1
          0.58004456          1.00000000
  1  1  1  1  1
          0.24329976          1.00000000
  1  1  1  1  1
          0.09682373          1.00000000
  1  2  2  7  1
        665.35057386          0.00059589
        200.17995366          0.00545943
         77.54508557          0.02798099
         33.67785435          0.09411917
         15.62492833          0.21825216
          7.44278674          0.33739971
          3.53360735          0.35141419
  1  2  2  1  1
          1.63637251          1.00000000
  1  2  2  1  1
          0.67845685          1.00000000
  1  2  2  1  1
          0.27000000          1.00000000
  1  3  3  1  1
          0.41300000          1.00000000
  1  3  3  1  1
          0.95570000          1.00000000
  1  4  4  1  1
          0.73950000          1.00000000