srDFT_G2/G09/Large_core/Molecules/avtz/SO2.inp
2019-04-04 11:10:45 +02:00

14 lines
126 B
Plaintext

%nproc=24
%mem=100GB
#p ROCCSD(T) aug-cc-pVTZ pop=full gfprint
G2
0,1
S
O,1,SO
O,1,SO,2,OSO
SO=1.44255426
OSO=119.22404594