***,acrolein, CASPT3(6,6)/aug-cc-pVTZ 1A' and triplet 1A'',2A'',3A'' calculation
memory,2000,m
file,2,acrolein_sa4cas6_avtz_3as.wfu
GEOMTYP=xyz
BOHR
GEOMETRY={
8
CC3/aug-cc-pVTZ S0 optimised geometry
C -1.11645072 -0.68348783  0.00000000
C  1.20647847  0.83714564  0.00000000
C  3.46831059 -0.28872636  0.00000000
O -3.23666415  0.19187203  0.00000000
H -0.80613858 -2.74747338  0.00000000
H  0.98699813  2.86613511  0.00000000
H  5.20930864  0.77443560  0.00000000
H  3.60951559 -2.33000749  0.00000000}

BASIS=AVTZ

INT

{MULTI
occ,13,5
closed,12,0
wf,30,1,0
wf,30,2,2
state,3
canonical
print,orbitals,civector}

{RS3,shift=0.3
wf,30,1,0}

{RS3,shift=0.3
wf,30,2,2}

{RS3,shift=0.3
wf,30,2,2
state,1,2}

{RS3,shift=0.3
wf,30,2,2
state,1,3}

{RS3,shift=0.3,ipea=0.25
wf,30,1,0}

{RS3,shift=0.3,ipea=0.25
wf,30,2,2}

{RS3,shift=0.3,ipea=0.25
wf,30,2,2
state,1,2}

{RS3,shift=0.3,ipea=0.25
wf,30,2,2
state,1,3}
---