%nprocshared=32
#p opt freq wb97xd/genecp scrf=(smd,solvent=acetonitrile)

wwww

0 1
 S                 -1.11641900   -0.00031900    0.45011400
 C                  0.62559100   -0.00008400    0.14928200
 O                 -1.51793100   -1.25176800    1.07582700
 O                 -1.51790000    1.25005900    1.07801400
 C                  1.28941800    1.21918800    0.03381900
 C                  1.28960000   -1.21919600    0.03315700
 C                  2.65872000    1.21066800   -0.21078800
 H                  0.74853100    2.15321400    0.13935400
 C                  2.65890300   -1.21034300   -0.21142700
 H                  0.74882500   -2.15334100    0.13818300
 C                  3.33912300    0.00024700   -0.33394500
 H                  3.19373200    2.14994700   -0.30208500
 H                  3.19406200   -2.14949100   -0.30321600
 H                  4.40781100    0.00037400   -0.52358500
 O                 -1.61071300    0.00101700   -1.08366600
 K                 -2.96236619    0.50087030   -1.90998379

-B -F -K -C -H -O -F -S -N
6-311G++(d,p)
*****




