%chk=PhSO2I_triplet_def2svp.chk
%mem=120GB
%nprocshared=24
#p opt freq=noraman b3lyp scrf=(smd,solvent=acetonitrile) pop=full def2svp empiricaldispersion=gd3bj gfinput iop(6/7=3) scf=save

Title Card Required

0 3
 S                 -0.95553900    1.80055400    0.00031400
 C                 -1.59763300    0.11358100    0.00019500
 C                 -1.77384200   -0.53207900   -1.22538700
 C                 -1.77361100   -0.53233700    1.22567400
 C                 -2.18856300   -1.86539500   -1.21460500
 H                 -1.60471200   -0.00935200   -2.16054000
 C                 -2.18833400   -1.86565100    1.21468800
 H                 -1.60430900   -0.00980700    2.16090600
 C                 -2.39214300   -2.52989400   -0.00000900
 H                 -2.34785200   -2.38343500   -2.15574300
 H                 -2.34744900   -2.38388900    2.15574700
 H                 -2.70671700   -3.56952800   -0.00009000
 O                 -1.33520200    2.44763500   -1.29404900
 O                 -1.33501700    2.44738200    1.29485900
 I                  2.24049400   -0.30834600   -0.00028500

