***,methylenecyclopropene, CSAPT3(4,6)/aug-cc-pVTZ S0 and 3 triplet A1 calculation memory,2000,m file,2,mcyclo_sa4cas6_avtz_3a1.wfu GEOMTYP=xyz BOHR GEOMETRY={ C 0.00000000 0.00000000 0.53512883 C 0.00000000 0.00000000 3.04739824 C 0.00000000 1.25042956 -1.88571561 C 0.00000000 -1.25042956 -1.88571561 H 0.00000000 2.96887531 -2.96270271 H 0.00000000 -2.96887531 -2.96270271 H 0.00000000 1.75335023 4.08608382 H 0.00000000 -1.75335023 4.08608382} BASIS=AVTZ INT {MULTI occ,8,5,4,1 closed,8,0,4,0 wf,28,1,0 wf,28,1,2 state,3 canonical print,orbitals,civector} {RS3,shift=0.3 wf,28,1,0} {RS3,shift=0.3 wf,28,1,2} {RS3,shift=0.3 wf,28,1,2 state,1,2} {RS3,shift=0.3 wf,28,1,2 state,1,3} {RS3,shift=0.3,ipea=0.25 wf,28,1,0} {RS3,shift=0.3,ipea=0.25 wf,28,1,2} {RS3,shift=0.3,ipea=0.25 wf,28,1,2 state,1,2} {RS3,shift=0.3,ipea=0.25 wf,28,1,2 state,1,3} ---