***,diazomethane, CASPT3(10,9)/aug-cc-pVTZ S0,1A" calculation (complete valence pi active space+ sigma CN/NN)
memory,2000,m
file,2,diazo_sa2cas9_avtz_1as.wfu
GEOMTYP=xyz
BOHR
GEOMETRY={
5
CC3/aug-cc-pVTZ S0 optimised geometry
C  1.80206107  0.00000000  -1.03389466
N -0.01743713  0.00000000   0.84742344
N -2.25203764  0.00000000   0.54034983
H  3.74280590  0.00000000  -0.44375913
H  1.20115546  0.00000000  -2.98380249}

BASIS=AVTZ

INT

{MULTI
occ,12,3
closed,6,0
wf,22,1,0
wf,22,2,0
canonical
print,orbitals,civector}

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

{RS3,shift=0.3
wf,22,2,0}

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

{RS3,shift=0.3,ipea=0.25
wf,22,2,0}
---