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#! RHF-CC2-LR/STO-3G optical rotation of (S)-methyloxirane.  gauge =
#! length, omega = (589 355 nm)

memory 250 mb

molecule smo {
  0 1
# structure from Pederson et al., CPL, submitted
  C  0.152133 -0.035800  0.485797
  C -1.039475  0.615938 -0.061249
  C  1.507144  0.097806 -0.148460
  O -0.828215 -0.788248 -0.239431
  H  0.153725 -0.249258  1.552136
  H -1.863178  0.881921  0.593333
  H -0.949807  1.214210 -0.962771
  H  2.076806 -0.826189 -0.036671
  H  2.074465  0.901788  0.325106
  H  1.414895  0.315852 -1.212218
}

set {
  basis "STO-3G"
  freeze_core true
  gauge length
  omega [589, 355, nm]
}

property('cc2',properties=['rotation'])