# CIS excited state calculation for H2O
basis=def2-SVP
calc=CIS
nsing=3
mem=50GB
#redcost_exc=on
molden=on
verbosity=3

geom=xyz
3

O          0.0000000000        0.0000000000       -0.0573384885
H          0.7581330543        0.0000000000        0.5338192442
H         -0.7581330543        0.0000000000        0.5338192442