#! RHF-CC2-LR/cc-pVDZ optical rotation of H2O2.  gauge = both, omega =
#! (589 355 nm)

memory 250 mb

molecule h2o2 {
  0 1
  O
  O 1 1.39
  H 1 0.94 2 102.3
  H 2 0.94 1 102.3 3 -50.0
}

set {
  basis "cc-pVDZ"
  freeze_core true
  gauge both
  omega [589, 355, nm]
}

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