%mem=3000MB
%nprocshared=4
#p opt=maxstep=6 freq=noraman b3lyp/6-311+g(d) scrf=(smd,solvent=water)
nosymm guess=always scf=qc empiricaldispersion=gd3 int=ultrafine

ch3sh-nh2_6311+Gd

-1 1
 C                 -1.22800600   -0.11678900    0.13310400
 H                 -1.32599700   -1.07859100   -0.36152200
 H                 -0.71642300    0.59977800   -0.50234000
 H                 -0.72486900   -0.22025700    1.09004000
 N                  1.97543500   -1.29789100   -0.52503500
 H                  1.12930300   -1.42142100   -1.09042900
 H                  1.64555000   -0.73471200    0.26539000
 S                 -2.86694409    0.50388836    0.44461891
 H                 -3.50381310    0.64634993   -0.69125194

