/usr/share/ccp4/atomsf_neutron.lib is in libccp4-data 6.4.5-2.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
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1 1 0.000000
-0.374000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
D
101 1 0.000000
0.667000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
H-1
1 2 0.000000
0.897661 0.565616 0.415815 0.116973
53.136799 15.187000 186.576004 3.567090
0.000000 0.000000 0.000000 0.000000
He
2 2 0.000000
0.873400 0.630900 0.311200 0.178000
9.103700 3.356800 22.927601 0.982100
0.000000 0.000000 0.000000 0.000000
Li
3 3 0.030000
1.128200 0.750800 0.617500 0.465300
3.954600 1.052400 85.390503 168.261002
0.001000 0.000000 0.000000 0.000000
Li+1
3 3 0.010000
0.696800 0.788800 0.341400 0.156300
4.623700 1.955700 0.631600 10.095300
0.001000 0.000000 0.000000 0.000000
Be
4 4 0.038500
1.591900 1.127800 0.539100 0.702900
43.642700 1.862300 103.483002 0.542000
0.003000 0.001000 0.000000 0.000000
Be+2
4 2 -6.109200
6.260300 0.884900 0.799300 0.164700
0.002700 0.831300 2.275800 5.114600
0.003000 0.001000 0.000000 0.000000
B
5 5 -0.193200
2.054500 1.332600 1.097900 0.706800
23.218500 1.021000 60.349800 0.140300
0.008000 0.004000 0.000000 0.001000
C
6 6 0.000000
0.665000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
Cv
6 6 0.000000
0.665000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
N
7 7 0.000000
0.921000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
O
8 8 0.000000
0.581000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
O-1
8 9 0.000000
0.581000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
F
9 9 0.277600
3.539200 2.641200 1.517000 1.024300
10.282500 4.294400 0.261500 26.147600
0.069000 0.053000 0.014000 0.010000
F-1
9 10 0.653396
3.632200 3.510570 1.260640 0.940706
5.277560 14.735300 0.442258 47.343700
0.069000 0.053000 0.014000 0.010000
Ne
10 10 0.351500
3.955300 3.112500 1.454600 1.125100
8.404200 3.426200 0.230600 21.718399
0.097000 0.083000 0.021000 0.016000
Na
11 11 0.676000
4.762600 3.173600 1.267400 1.112800
3.285000 8.842200 0.313600 129.423996
0.129000 0.124000 0.030000 0.025000
Na+1
11 10 0.404000
3.256500 3.936200 1.399800 1.003200
2.667100 6.115300 0.200100 14.039000
0.129000 0.124000 0.030000 0.025000
Mg
12 12 0.858400
5.420400 2.173500 1.226900 2.307300
2.827500 79.261101 0.380800 7.193700
0.165000 0.177000 0.042000 0.036000
Mg+2
12 10 0.485300
3.498800 3.837800 1.328400 0.849700
2.167600 4.754200 0.185000 10.141100
0.165000 0.177000 0.042000 0.036000
Al
13 13 1.115100
6.420200 1.900200 1.593600 1.964600
3.038700 0.742600 31.547199 85.088600
0.204000 0.246000 0.056000 0.052000
Al+3
13 10 0.706786
4.174480 3.387600 1.202960 0.528137
1.938160 4.145530 0.228753 8.285240
0.204000 0.246000 0.056000 0.052000
Si
14 14 1.140700
6.291500 3.035300 1.989100 1.541000
2.438600 32.333698 0.678500 81.693703
0.244000 0.330000 0.072000 0.071000
Siv
14 14 1.247070
5.662690 3.071640 2.624460 1.393200
2.665200 38.663399 0.916946 93.545799
0.244000 0.330000 0.072000 0.071000
Si+4
14 10 0.746297
4.439180 3.203450 1.194530 0.416530
1.641670 3.437570 0.214900 6.653650
0.244000 0.330000 0.072000 0.071000
P
15 15 0.000000
0.510000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
S
16 16 0.000000
0.510000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
Cl
17 17 -9.557400
11.460400 7.196400 6.255600 1.645500
0.010400 1.166200 18.519400 47.778400
0.348000 0.702000 0.132000 0.159000
Cl-1
17 18 -16.378000
18.291500 7.208400 6.533700 2.338600
0.006600 1.171700 19.542400 60.448601
0.348000 0.702000 0.132000 0.159000
Ar
18 18 1.444500
7.484500 6.772300 0.653900 1.644200
0.907200 14.840700 43.898300 33.392899
0.366000 0.872000 0.155000 0.201000
K
19 19 1.422800
8.218600 7.439800 1.051900 0.865900
12.794900 0.774800 213.186996 41.684101
0.365000 1.066000 0.179000 0.250000
K+1
19 18 -4.997800
7.957800 7.491700 6.359000 1.191500
12.633100 0.767400 -0.002000 31.912800
0.365000 1.066000 0.179000 0.250000
Ca
20 20 1.375100
8.626600 7.387300 1.589900 1.021100
10.442100 0.659900 85.748398 178.436996
0.341000 1.286000 0.203000 0.306000
Ca+2
20 18 -14.875000
15.634800 7.951800 8.437200 0.853700
-0.007400 0.608900 10.311600 25.990499
0.341000 1.286000 0.203000 0.306000
Sc
21 21 1.332900
9.189000 7.367900 1.640900 1.468000
9.021300 0.572900 136.108002 51.353100
0.285000 1.533000 0.226000 0.372000
Sc+3
21 18 -6.666700
14.400800 8.027300 1.659430 1.579360
0.298540 7.962900 -0.286040 16.066200
0.285000 1.533000 0.226000 0.372000
Ti
22 22 1.280700
9.759500 7.355800 1.699100 1.902100
7.850800 0.500000 35.633801 116.105003
0.189000 1.807000 0.248000 0.446000
Ti+2
22 20 0.897155
9.114230 7.621740 2.279300 0.087899
7.524300 0.457585 19.536100 61.655800
0.189000 1.807000 0.248000 0.446000
Ti+3
22 19 -14.652000
17.734400 8.738160 5.256910 1.921340
0.220610 7.047160 -0.157620 15.976800
0.189000 1.807000 0.248000 0.446000
Ti+4
22 18 -13.280000
19.511400 8.234730 2.013410 1.520800
0.178847 6.670180 -0.292630 12.946400
0.189000 1.807000 0.248000 0.446000
V
23 23 1.219900
10.297100 7.351100 2.070300 2.057100
6.865700 0.438500 26.893801 102.477997
0.035000 2.110000 0.267000 0.530000
V+2
23 21 1.229800
10.106000 7.354100 2.288400 0.022300
6.881800 0.440900 20.300400 115.122002
0.035000 2.110000 0.267000 0.530000
V+3
23 19 0.656565
9.431410 7.741900 2.153430 0.016865
6.395350 0.383349 15.190800 63.969002
0.035000 2.110000 0.267000 0.530000
V+5
23 18 1.714300
15.688700 8.142080 2.030810 -9.576000
0.679003 5.401350 9.972780 0.940464
0.035000 2.110000 0.267000 0.530000
Cr
24 24 1.183200
10.640600 7.353700 3.324000 1.492200
6.103800 0.392000 20.262600 98.739899
-0.198000 2.443000 0.284000 0.624000
Cr+2
24 22 0.616898
9.540340 7.750900 3.582740 0.509107
5.660780 0.344261 13.307500 32.422401
-0.198000 2.443000 0.284000 0.624000
Cr+3
24 21 0.518275
9.680900 7.811360 2.876030 0.113575
5.594630 0.334393 12.828800 32.876099
-0.198000 2.443000 0.284000 0.624000
Mn
25 25 1.089600
11.281900 7.357300 3.019300 2.244100
5.340900 0.343200 17.867399 83.754303
-0.568000 2.808000 0.295000 0.729000
Mn+2
25 23 1.087400
10.806100 7.362000 3.526800 0.218400
5.279600 0.343500 14.343000 41.323502
-0.568000 2.808000 0.295000 0.729000
Mn+3
25 22 0.393974
9.845210 7.871940 3.565310 0.323613
4.917970 0.294393 10.817100 24.128099
-0.568000 2.808000 0.295000 0.729000
Mn+4
25 21 0.251877
9.962530 7.970570 2.760670 0.054447
4.848500 0.283303 10.485200 27.573000
-0.568000 2.808000 0.295000 0.729000
Fe
26 26 1.036900
11.769500 7.357300 3.522200 2.304500
4.761100 0.307200 15.353500 76.880501
-1.179000 3.204000 0.301000 0.845000
Fe+2
26 24 1.009700
11.042400 7.374000 4.134600 0.439900
4.653800 0.305300 12.054600 31.280899
-1.179000 3.204000 0.301000 0.845000
Fe+3
26 23 0.970700
11.176400 7.386300 3.394800 0.072400
4.614700 0.300500 11.672900 38.556599
-1.179000 3.204000 0.301000 0.845000
Co
27 27 0.000000
0.280000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
Co+2
27 25 0.000000
0.280000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
Co+3
27 24 0.000000
0.280000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
Ni
28 28 1.034100
12.837600 7.292000 4.443800 2.380000
3.878500 0.256500 12.176300 66.342102
-2.956000 0.509000 0.285000 1.113000
Ni+2
28 26 0.861400
11.416600 7.400500 5.344200 0.977300
3.676600 0.244900 8.873000 22.162600
-2.956000 0.509000 0.285000 1.113000
Ni+3
28 25 0.386044
10.780600 7.758680 5.227460 0.847114
3.547700 0.223140 7.644680 16.967300
-2.956000 0.509000 0.285000 1.113000
Cu
29 29 1.191000
13.338000 7.167600 5.615800 1.673500
3.582800 0.247000 11.396600 64.812599
-2.019000 0.589000 0.263000 1.266000
Cu+1
29 28 0.890000
11.947500 7.357300 6.245500 1.557800
3.366900 0.227400 8.662500 25.848700
-2.019000 0.589000 0.263000 1.266000
Cu+2
29 27 1.144310
11.816800 7.111810 5.781350 1.145230
3.374840 0.244078 7.987600 19.896999
-2.019000 0.589000 0.263000 1.266000
Zn
30 30 1.304100
14.074300 7.031800 5.162500 2.410000
3.265500 0.233300 10.316300 58.709702
-1.612000 0.678000 0.222000 1.431000
Zn+2
30 28 0.780700
11.971900 7.386200 6.466800 1.394000
2.994600 0.203100 7.082600 18.099501
-1.612000 0.678000 0.222000 1.431000
Ga
31 31 1.718900
15.235400 6.700600 4.359100 2.962300
3.066900 0.241200 10.780500 61.413502
-1.354000 0.777000 0.163000 1.609000
Ga+3
31 28 1.535450
12.692000 6.698830 6.066920 1.006600
2.812620 0.227890 6.364410 14.412200
-1.354000 0.777000 0.163000 1.609000
Ge
32 32 2.131300
16.081600 6.374700 3.706800 3.683000
2.850900 0.251600 11.446800 54.762501
-1.163000 0.886000 0.081000 1.801000
Ge+4
32 28 1.455720
12.917200 6.700030 6.067910 0.859041
2.537180 0.205855 5.479130 11.603000
-1.163000 0.886000 0.081000 1.801000
As
33 33 2.531000
16.672300 6.070100 3.431300 4.277900
2.634500 0.264700 12.947900 47.797199
-1.011000 1.006000 -0.030000 2.007000
Se
34 34 2.840900
17.000601 5.819600 3.973100 4.354300
2.409800 0.272600 15.237200 43.816299
-0.879000 1.139000 -0.178000 2.223000
Br
35 35 2.955700
17.178900 5.235800 5.637700 3.985100
2.172300 16.579599 0.260900 41.432800
-0.767000 1.283000 -0.374000 2.456000
Br-1
35 36 3.177600
17.171801 6.333800 5.575400 3.727200
2.205900 19.334499 0.287100 58.153500
-0.767000 1.283000 -0.374000 2.456000
Kr
36 36 2.825000
17.355499 6.728600 5.549300 3.537500
1.938400 16.562300 0.226100 39.397202
-0.665000 1.439000 -0.652000 2.713000
Rb
37 37 3.487300
17.178400 9.643500 5.139900 1.529200
1.788800 17.315100 0.274800 164.934006
-0.574000 1.608000 -1.044000 2.973000
Rb+1
37 36 2.078200
17.581600 7.659800 5.898100 2.781700
1.713900 14.795700 0.160300 31.208700
-0.574000 1.608000 -1.044000 2.973000
Sr
38 38 2.506400
17.566299 9.818400 5.422000 2.669400
1.556400 14.098800 0.166400 132.376007
-0.465000 1.820000 -1.657000 3.264000
Sr+2
38 36 41.402500
18.087400 8.137300 2.565400 -34.193001
1.490700 12.696300 24.565100 -0.013800
-0.465000 1.820000 -1.657000 3.264000
Y
39 39 1.912130
17.775999 10.294600 5.726290 3.265880
1.402900 12.800600 0.125599 104.353996
-0.386000 2.025000 -2.951000 3.542000
Y+3
39 36 40.260201
17.926800 9.153100 1.767950 -33.108002
1.354170 11.214500 22.659901 -0.013190
-0.386000 2.025000 -2.951000 3.542000
Zr
40 40 2.069290
17.876499 10.948000 5.417320 3.657210
1.276180 11.916000 0.117622 87.662697
-0.314000 2.245000 -2.965000 0.560000
Zr+4
40 36 9.414540
18.166800 10.056200 1.011180 -2.647900
1.214800 10.148300 21.605400 -0.102760
-0.314000 2.245000 -2.965000 0.560000
Nb
41 41 3.755910
17.614201 12.014400 4.041830 3.533460
1.188650 11.766000 0.204785 69.795700
-0.248000 2.482000 -2.197000 0.621000
Nb+3
41 38 -12.912000
19.881201 18.065300 11.017700 1.947150
0.019175 1.133050 10.162100 28.338900
-0.248000 2.482000 -2.197000 0.621000
Nb+5
41 36 -6.393400
17.916300 13.341700 10.799000 0.337905
1.124460 0.028781 9.282060 25.722799
-0.248000 2.482000 -2.197000 0.621000
Mo
42 42 4.387500
3.702500 17.235600 12.887600 3.742900
0.277200 1.095800 11.004000 61.658401
-0.191000 2.735000 -1.825000 0.688000
Mo+3
42 39 -14.421000
21.166401 18.201700 11.742300 2.309510
0.014734 1.030310 9.536590 26.630699
-0.191000 2.735000 -1.825000 0.688000
Mo+5
42 37 -14.316000
21.014900 18.099199 11.463200 0.740625
0.014345 1.022380 8.788090 23.345200
-0.191000 2.735000 -1.825000 0.688000
Mo+6
42 36 0.344941
17.887100 11.175000 6.578910 0.000000
1.036490 8.480610 0.058881 0.000000
-0.191000 2.735000 -1.825000 0.688000
Tc
43 43 5.404280
19.130100 11.094800 4.649010 2.712630
0.864132 8.144870 21.570700 86.847198
-0.145000 3.005000 -0.590000 0.759000
Ru
44 44 5.378740
19.267401 12.918200 4.863370 1.567560
0.808520 8.434670 24.799700 94.292801
-0.105000 3.296000 -1.420000 0.836000
Ru+3
44 41 -3.189200
18.563801 13.288500 9.326020 3.009640
0.847329 8.371640 0.017662 22.886999
-0.105000 3.296000 -1.420000 0.836000
Ru+4
44 40 1.423570
18.500299 13.178700 4.713040 2.185350
0.844582 8.125340 0.364950 20.850401
-0.105000 3.296000 -1.420000 0.836000
Rh
45 45 5.328000
19.295700 14.350100 4.734250 1.289180
0.751536 8.217580 25.874901 98.606201
-0.077000 3.605000 -1.287000 0.919000
Rh+3
45 42 11.867800
18.878500 14.125900 3.325150 -6.198900
0.764252 7.844380 21.248699 -0.010360
-0.077000 3.605000 -1.287000 0.919000
Rh+4
45 41 11.283500
18.854500 13.980600 2.534640 -5.652600
0.760825 7.624360 19.331699 -0.010200
-0.077000 3.605000 -1.287000 0.919000
Pd
46 46 5.265930
19.331900 15.501700 5.295370 0.605844
0.698655 7.989290 25.205200 76.898598
-0.059000 3.934000 -1.177000 1.007000
Pd+2
46 44 5.291600
19.170099 15.209600 4.322340 0.000000
0.696219 7.555730 22.505699 0.000000
-0.059000 3.934000 -1.177000 1.007000
Pd+4
46 42 13.017400
19.249300 14.790000 2.892890 -7.949200
0.683839 7.148330 17.914400 0.005127
-0.059000 3.934000 -1.177000 1.007000
Ag
47 47 5.179000
19.280800 16.688499 4.804500 1.046300
0.644600 7.472600 24.660500 99.815598
-0.060000 4.282000 -1.085000 1.101000
Ag+1
47 46 5.215720
19.181200 15.971900 5.274750 0.357534
0.646179 7.191230 21.732599 66.114700
-0.060000 4.282000 -1.085000 1.101000
Ag+2
47 45 5.214040
19.164301 16.245600 4.370900 0.000000
0.645643 7.185440 21.407200 0.000000
-0.060000 4.282000 -1.085000 1.101000
Cd
48 48 5.069400
19.221399 17.644400 4.461000 1.602900
0.594600 6.908900 24.700800 87.482498
-0.079000 4.653000 -1.005000 1.202000
Cd+2
48 46 5.119370
19.151400 17.253500 4.471280 0.000000
0.597922 6.806390 20.252100 0.000000
-0.079000 4.653000 -1.005000 1.202000
In
49 49 4.939100
19.162399 18.559601 4.294800 2.039600
0.547600 6.377600 25.849899 92.802902
-0.126000 5.045000 -0.936000 1.310000
In+3
49 46 4.996350
19.104500 18.110800 3.788970 0.000000
0.551522 6.324700 17.359501 0.000000
-0.126000 5.045000 -0.936000 1.310000
Sn
50 50 4.782100
19.188900 19.100500 4.458500 2.466300
5.830300 0.503100 26.890900 83.957100
-0.194000 5.459000 -0.873000 1.424000
Sn+2
50 48 4.786100
19.109400 19.054800 4.564800 0.487000
0.503600 5.837800 23.375200 62.206100
-0.194000 5.459000 -0.873000 1.424000
Sn+4
50 46 3.918200
18.933300 19.713100 3.418200 0.019300
5.764000 0.465500 14.004900 -0.758300
-0.194000 5.459000 -0.873000 1.424000
Sb
51 51 4.590900
19.641800 19.045500 5.037100 2.682700
5.303400 0.460700 27.907400 75.282501
-0.287000 5.894000 -0.816000 1.546000
Sb+3
51 48 4.696260
18.975500 18.933001 5.107890 0.288753
0.467196 5.221260 19.590200 55.511299
-0.287000 5.894000 -0.816000 1.546000
Sb+5
51 46 4.692630
19.868500 19.030199 2.412530 0.000000
5.448530 0.467973 14.125900 0.000000
-0.287000 5.894000 -0.816000 1.546000
Te
52 52 4.352000
19.964399 19.013800 6.144870 2.523900
4.817420 0.420885 28.528400 70.840302
-0.418000 6.352000 -0.772000 1.675000
I
53 53 4.071200
20.147200 18.994900 7.513800 2.273500
4.347000 0.381400 27.766001 66.877602
-0.579000 6.835000 -0.726000 1.812000
I-1
53 54 4.071400
20.233200 18.997000 7.806900 2.886800
4.357900 0.381500 29.525900 84.930397
-0.579000 6.835000 -0.726000 1.812000
Xe
54 54 3.711800
20.293301 19.029800 8.976700 1.990000
3.928200 0.344000 26.465900 64.265800
-0.783000 7.348000 -0.684000 1.958000
Cs
55 55 3.335200
20.389200 19.106199 10.662000 1.495300
3.569000 0.310700 24.387899 213.904007
-1.022000 7.904000 -0.644000 2.119000
Cs+1
55 54 3.279100
20.352400 19.127800 10.282100 0.961500
3.552000 0.308600 23.712799 59.456501
-1.022000 7.904000 -0.644000 2.119000
Ba
56 56 2.773100
20.336100 19.297001 10.888000 2.695900
3.216000 0.275600 20.207300 167.201996
-1.334000 8.460000 -0.613000 2.282000
Ba+2
56 54 3.029020
20.180700 19.113600 10.905400 0.776340
3.213670 0.283310 20.055799 51.745998
-1.334000 8.460000 -0.613000 2.282000
La
57 57 2.146780
20.577999 19.599001 11.372700 3.287190
2.948170 0.244475 18.772600 133.123993
-1.716000 9.036000 -0.588000 2.452000
La+3
57 54 2.408600
20.248899 19.376301 11.632300 0.336048
2.920700 0.250698 17.821100 54.945301
-1.716000 9.036000 -0.588000 2.452000
Ce
58 58 1.862640
21.167101 19.769501 11.851300 3.330490
2.812190 0.226836 17.608299 127.112999
-2.170000 9.648000 -0.564000 2.632000
Ce+3
58 55 2.090130
20.803600 19.559000 11.936900 0.612376
2.776910 0.231540 16.540800 43.169201
-2.170000 9.648000 -0.564000 2.632000
Ce+4
58 54 1.591800
20.323500 19.818600 12.123300 0.144583
2.659410 0.218850 15.799200 62.235500
-2.170000 9.648000 -0.564000 2.632000
Pr
59 59 2.058300
22.044001 19.669701 12.385600 2.824280
2.773930 0.222087 16.766899 143.643997
-2.939000 10.535000 -0.530000 2.845000
Pr+3
59 56 1.771320
21.372700 19.749100 12.132900 0.975180
2.645200 0.214299 15.323000 36.406502
-2.939000 10.535000 -0.530000 2.845000
Pr+4
59 55 1.242850
20.941299 20.053900 12.466800 0.296689
2.544670 0.202481 14.813700 45.464298
-2.939000 10.535000 -0.530000 2.845000
Nd
60 60 1.984860
22.684500 19.684700 12.774000 2.851370
2.662480 0.210628 15.885000 137.903000
-3.431000 10.933000 -0.535000 3.018000
Nd+3
60 57 1.475880
21.961000 19.933901 12.120000 1.510310
2.527220 0.199237 14.178300 30.871700
-3.431000 10.933000 -0.535000 3.018000
Pm
61 61 2.028760
23.340500 19.609501 13.123500 2.875160
2.562700 0.202088 15.100900 132.720993
-4.357000 11.614000 -0.530000 3.225000
Pm+3
61 58 1.194990
22.552700 20.110800 12.067100 2.074920
2.417400 0.185769 13.127500 27.449100
-4.357000 11.614000 -0.530000 3.225000
Sm
62 62 2.209630
24.004200 19.425800 13.439600 2.896040
2.472740 0.196451 14.399600 128.007004
-5.696000 12.320000 -0.533000 3.442000
Sm+3
62 58 0.954586
23.150400 20.259899 11.920200 2.714880
2.316410 0.174081 12.157100 24.824200
-5.696000 12.320000 -0.533000 3.442000
Eu
63 63 2.574500
24.627399 19.088600 13.760300 2.922700
2.387900 0.194200 13.754600 123.174004
-7.718000 11.276000 -0.542000 3.669000
Eu+2
63 61 1.363890
24.006300 19.950399 11.803400 3.872430
2.277830 0.173530 11.609600 26.515600
-7.718000 11.276000 -0.542000 3.669000
Eu+3
63 60 0.759344
23.749701 20.374500 11.850900 3.265030
2.222580 0.163940 11.311000 22.996599
-7.718000 11.276000 -0.542000 3.669000
Gd
64 64 2.419600
25.070900 19.079800 13.851800 3.545450
2.253410 0.181951 12.933100 101.398003
-9.242000 11.946000 -0.564000 3.904000
Gd+3
64 61 0.645089
24.346600 20.420799 11.870800 3.714900
2.135530 0.155525 10.578200 21.702900
-9.242000 11.946000 -0.564000 3.904000
Tb
65 65 3.582240
25.897600 18.218500 14.316700 2.953540
2.242560 0.196143 12.664800 115.362000
-9.498000 9.242000 -0.591000 4.151000
Tb+3
65 62 0.691967
24.955900 20.327101 12.247100 3.773000
2.056010 0.149525 10.049900 21.277300
-9.498000 9.242000 -0.591000 4.151000
Dy
66 66 4.297280
26.507000 17.638300 14.559600 2.965770
2.180200 0.202172 12.189900 111.874001
-10.423000 9.748000 -0.619000 4.410000
Dy+3
66 63 0.689690
25.539499 20.286100 11.981200 4.500730
1.980400 0.143384 9.349720 19.580999
-10.423000 9.748000 -0.619000 4.410000
Ho
67 67 4.567960
26.904900 17.294001 14.558300 3.638370
2.070510 0.197940 11.440700 92.656601
-12.255000 3.704000 -0.666000 4.678000
Ho+3
67 64 0.852795
26.129601 20.099400 11.978800 4.936760
1.910720 0.139358 8.800180 18.590799
-12.255000 3.704000 -0.666000 4.678000
Er
68 68 5.920460
27.656300 16.428499 14.977900 2.982330
2.073560 0.223545 11.360400 105.703003
-9.733000 3.937000 -0.723000 4.958000
Er+3
68 65 1.176130
26.722000 19.774799 12.150600 5.173790
1.846590 0.137290 8.362250 17.897400
-9.733000 3.937000 -0.723000 4.958000
Tm
69 69 6.756210
28.181900 15.885100 15.154200 2.987060
2.028590 0.238849 10.997500 102.960999
-8.488000 4.181000 -0.795000 5.248000
Tm+3
69 66 1.639290
27.308300 19.332001 12.333900 5.383480
1.787110 0.136974 7.967780 17.292200
-8.488000 4.181000 -0.795000 5.248000
Yb
70 70 7.566720
28.664101 15.434500 15.308700 2.989630
1.988900 0.257119 10.664700 100.417000
-7.701000 4.432000 -0.884000 5.548000
Yb+2
70 68 3.709830
28.120899 17.681700 13.333500 5.146570
1.785030 0.159970 8.183040 20.389999
-7.701000 4.432000 -0.884000 5.548000
Yb+3
70 67 2.260010
27.891701 18.761400 12.607200 5.476470
1.732720 0.138790 7.644120 16.814301
-7.701000 4.432000 -0.884000 5.548000
Lu
71 71 7.976280
28.947599 15.220800 15.100000 3.716010
1.901820 9.985190 0.261033 84.329803
-7.133000 4.693000 -0.988000 5.858000
Lu+3
71 68 2.975730
28.462799 18.121000 12.842900 5.594150
1.682160 0.142292 7.337270 16.353500
-7.133000 4.693000 -0.988000 5.858000
Hf
72 72 8.581540
29.143999 15.172600 14.758600 4.300130
1.832620 9.599900 0.275116 72.028999
-6.715000 4.977000 -1.118000 6.185000
Hf+4
72 68 2.396990
28.813101 18.460100 12.728500 5.599270
1.591360 0.128903 6.762320 14.036600
-6.715000 4.977000 -1.118000 6.185000
Ta
73 73 9.243540
29.202400 15.229300 14.513500 4.764920
1.773330 9.370460 0.295977 63.364399
-6.351000 5.271000 -1.258000 6.523000
Ta+5
73 68 1.785550
29.158701 18.840700 12.826800 5.386950
1.507110 0.116741 6.315240 12.424400
-6.351000 5.271000 -1.258000 6.523000
W
74 74 9.887500
29.081800 15.430000 14.432700 5.119820
1.720290 9.225900 0.321703 57.056000
-6.048000 5.577000 -1.421000 6.872000
W+6
74 68 1.010740
29.493601 19.376301 13.054400 5.064120
1.427550 0.104621 5.936670 11.197200
-6.048000 5.577000 -1.421000 6.872000
Re
75 75 10.472000
28.762100 15.718900 14.556400 5.441740
1.671910 9.092270 0.350500 52.086102
-5.790000 5.891000 -1.598000 7.232000
Os
76 76 11.000500
28.189400 16.155001 14.930500 5.675890
1.629030 8.979480 0.382661 48.164700
-5.581000 6.221000 -1.816000 7.605000
Os+4
76 72 6.498040
30.419001 15.263700 14.745800 5.067950
1.371130 6.847060 0.165191 18.003000
-5.581000 6.221000 -1.816000 7.605000
Ir
77 77 11.472200
27.304899 16.729601 15.611500 5.833770
1.592790 8.865530 0.417916 45.001099
-5.391000 6.566000 -2.066000 7.990000
Ir+3
77 74 8.279030
30.415600 15.862000 13.614500 5.820080
1.343230 7.109090 0.204633 20.325399
-5.391000 6.566000 -2.066000 7.990000
Ir+4
77 73 6.968240
30.705799 15.551200 14.232600 5.536720
1.309230 6.719830 0.167252 17.491100
-5.391000 6.566000 -2.066000 7.990000
Pt
78 78 11.688300
27.005899 17.763901 15.713100 5.783700
1.512930 8.811740 0.424593 38.610298
-5.233000 6.925000 -2.352000 8.388000
Pt+2
78 76 9.853290
29.842899 16.722401 13.215300 6.352340
1.329270 7.389790 0.263297 22.942600
-5.233000 6.925000 -2.352000 8.388000
Pt+4
78 74 7.395340
30.961201 15.982900 13.734800 5.920340
1.248130 6.608340 0.168640 16.939199
-5.233000 6.925000 -2.352000 8.388000
Au
79 79 12.065800
16.881901 18.591299 25.558201 5.860000
0.461100 8.621600 1.482600 36.395599
-5.096000 7.297000 -2.688000 8.798000
Au+1
79 78 11.229900
28.010900 17.820400 14.335900 6.580770
1.353210 7.739500 0.356752 26.404301
-5.096000 7.297000 -2.688000 8.798000
Au+3
79 76 9.096800
30.688601 16.902901 12.780100 6.523540
1.219900 6.828720 0.212867 18.659000
-5.096000 7.297000 -2.688000 8.798000
Hg
80 80 12.608900
20.680901 19.041700 21.657499 5.967600
0.545000 8.448400 1.572900 38.324600
-4.990000 7.686000 -3.084000 9.223000
Hg+1
80 79 12.020500
25.085300 18.497299 16.888300 6.482160
1.395070 7.651050 0.443378 28.226200
-4.990000 7.686000 -3.084000 9.223000
Hg+2
80 78 10.626800
29.564100 18.059999 12.837400 6.899120
1.211520 7.056390 0.284738 20.748199
-4.990000 7.686000 -3.084000 9.223000
Tl
81 81 13.174600
27.544600 19.158400 15.538000 5.525930
0.655150 8.707510 1.963470 45.814899
-4.883000 8.089000 -3.556000 9.659000
Tl+1
81 80 12.525800
21.398500 20.472300 18.747801 6.828470
1.471100 0.517394 7.434630 28.848200
-4.883000 8.089000 -3.556000 9.659000
Tl+3
81 78 9.802700
30.869499 18.384100 11.932800 7.005740
1.100800 6.538520 0.219074 17.211399
-4.883000 8.089000 -3.556000 9.659000
Pb
82 82 13.411800
31.061701 13.063700 18.441999 5.969600
0.690200 2.357600 8.618000 47.257900
-4.818000 8.505000 -4.133000 10.102000
Pb+2
82 80 12.473400
21.788601 19.568199 19.140600 7.011070
1.336600 0.488383 6.772700 23.813200
-4.818000 8.505000 -4.133000 10.102000
Pb+4
82 78 8.084280
32.124401 18.800301 12.017500 6.968860
1.005660 6.109260 0.147041 14.714000
-4.818000 8.505000 -4.133000 10.102000
Bi
83 83 13.578200
33.368900 12.951000 16.587700 6.469200
0.704000 2.923800 8.793700 48.009300
-4.776000 8.930000 -4.861000 10.559000
Bi+3
83 80 12.471100
21.805300 19.502600 19.105301 7.102950
1.235600 6.241490 0.469999 20.318501
-4.776000 8.930000 -4.861000 10.559000
Bi+5
83 78 -6.799400
33.536400 25.094601 19.249701 6.915550
0.916540 0.390420 5.714140 12.828500
-4.776000 8.930000 -4.861000 10.559000
Po
84 84 13.677000
34.672600 15.473300 13.113800 7.025880
0.700999 3.550780 9.556420 47.004501
-4.756000 9.383000 -5.924000 11.042000
At
85 85 13.710800
35.316299 19.021099 9.498870 7.425180
0.685870 3.974580 11.382400 45.471500
-4.772000 9.843000 -7.444000 9.961000
Rn
86 86 13.690500
35.563099 21.281601 8.003700 7.443300
0.663100 4.069100 14.042200 44.247299
-4.787000 10.317000 -8.862000 10.403000
Fr
87 87 13.724700
35.929901 23.054701 12.143900 2.112530
0.646453 4.176190 23.105200 150.645004
-4.833000 10.803000 -7.912000 7.754000
Ra
88 88 13.621100
35.763000 22.906401 12.473900 3.210970
0.616341 3.871350 19.988701 142.324997
-4.898000 11.296000 -7.620000 8.105000
Ra+2
88 86 13.543100
35.215000 21.670000 7.913420 7.650780
0.604909 3.576700 12.601000 29.843599
-4.898000 11.296000 -7.620000 8.105000
Ac
89 89 13.526600
35.659698 23.103201 12.597700 4.086550
0.589092 3.651550 18.599001 117.019997
-4.994000 11.799000 -7.725000 8.472000
Ac+3
89 86 13.463700
35.173599 22.111200 8.192160 7.055450
0.579689 3.414370 12.918700 25.944300
-4.994000 11.799000 -7.725000 8.472000
Th
90 90 13.431400
35.564499 23.421900 12.747300 4.807030
0.563359 3.462040 17.830900 99.172203
-5.091000 12.330000 -8.127000 8.870000
Th+4
90 86 13.376000
35.100700 22.441799 9.785540 5.294440
0.555054 3.244980 13.466100 23.953300
-5.091000 12.330000 -8.127000 8.870000
Pa
91 91 13.428700
35.884701 23.294800 14.189100 4.172870
0.547751 3.415190 16.923500 105.250999
-5.216000 12.868000 -8.960000 9.284000
U
92 92 13.396600
36.022800 23.412800 14.949100 4.188000
0.529300 3.325300 16.092699 100.612999
-5.359000 13.409000 -10.673000 9.654000
U+3
92 89 13.309200
35.574699 22.525900 12.216500 5.370730
0.520480 3.122930 12.714800 26.339399
-5.359000 13.409000 -10.673000 9.654000
U+4
92 88 13.267100
35.371498 22.532600 12.029100 4.798400
0.516598 3.050530 12.572300 23.458200
-5.359000 13.409000 -10.673000 9.654000
U+6
92 86 13.166500
34.850899 22.758400 14.009900 1.214570
0.507079 2.890300 13.176700 25.201700
-5.359000 13.409000 -10.673000 9.654000
Np
93 93 13.357300
36.187401 23.596399 15.640200 4.185500
0.511929 3.253960 15.362200 97.490799
-5.529000 13.967000 -11.158000 4.148000
Np+3
93 90 13.254400
35.707401 22.613001 12.989800 5.432270
0.502322 3.038070 12.144900 25.492800
-5.529000 13.967000 -11.158000 4.148000
Np+4
93 89 13.211600
35.510300 22.578699 12.776600 4.921590
0.498626 2.966270 11.948400 22.750200
-5.529000 13.967000 -11.158000 4.148000
Np+6
93 87 13.113000
35.013599 22.728600 14.388400 1.756690
0.489810 2.810990 12.330000 22.658100
-5.529000 13.967000 -11.158000 4.148000
Pu
94 94 13.381200
36.525398 23.808300 16.770700 3.479470
0.499384 3.263710 14.945500 105.980003
-5.712000 14.536000 -9.725000 4.330000
Pu+3
94 91 13.199100
35.840000 22.716900 13.580700 5.660160
0.484936 2.961180 11.533100 24.399200
-5.712000 14.536000 -9.725000 4.330000
Pu+4
94 90 13.155500
35.649300 22.646000 13.359500 5.188310
0.481422 2.890200 11.316000 21.830099
-5.712000 14.536000 -9.725000 4.330000
Pu+6
94 88 13.058200
35.173599 22.718100 14.763500 2.286780
0.473204 2.738480 11.553000 20.930300
-5.712000 14.536000 -9.725000 4.330000
Am
95 95 13.359200
36.670601 24.099199 17.341499 3.493310
0.483629 3.206470 14.313600 102.273003
-5.930000 15.087000 -8.926000 4.511000
Cm
96 96 13.288700
36.648800 24.409599 17.399000 4.216650
0.465154 3.089970 13.434600 88.483398
-6.176000 15.634000 -8.416000 4.697000
Bk
97 97 13.275400
36.788101 24.773600 17.891899 4.232840
0.451018 3.046190 12.894600 86.002998
-6.498000 16.316999 -7.990000 4.908000
Cf
98 98 13.267400
36.918499 25.199499 18.331699 4.243910
0.437533 3.007750 12.404400 83.788101
-6.798000 16.930000 -7.683000 5.107000
H 2
1 1 0.000000
0.793200 0.194900 0.000000 0.000000
24.215700 2.108900 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
C 2
6 6 0.000000
2.997200 2.979100 0.000000 0.000000
30.016701 2.888600 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
N 2
7 7 0.000000
2.992400 3.998600 0.000000 0.000000
25.376600 3.500400 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
O 2
8 8 0.000000
2.448500 5.558900 0.000000 0.000000
24.756201 4.137200 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
S 2
16 16 0.000000
5.548000 10.424100 0.000000 0.000000
33.710800 1.903400 0.000000 0.000000
0.000000 0.000000 0.000000 0.000000
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