***,cyclopropene, CASPT3(8,8)/aug-cc-pVTZ 1A1, 1B2 calculation
memory,2000,m
file,2,cyclopropene_cas8_avtz_1b2.wfu
GEOMTYP=xyz
BOHR
GEOMETRY={
7
CC3/aug-cc-pVTZ S0 optimised geometry
C  0.00000000   0.00000000    -1.66820880
C  0.00000000   1.22523906     0.90681419
C  0.00000000  -1.22523906     0.90681419
H  1.72255446   0.00000000    -2.77881149
H -1.72255446   0.00000000    -2.77881149
H  0.00000000   2.97844519     1.92076771
H  0.00000000  -2.97844519     1.92076771}

BASIS=AVTZ

INT

{MULTI
occ,7,2,5,1
closed,4,1,2,0
wf,22,1,0
wf,22,3,0
canonical
print,orbitals,civector}

{RS3,shift=0.3
wf,22,1,0}

{RS3,shift=0.3
wf,22,3,0}

{RS3,shift=0.3,ipea=0.25
wf,22,1,0}

{RS3,shift=0.3,ipea=0.25
wf,22,3,0}
---