%mem=16000MB
%nprocshared=12
#p opt=(maxstep=4) freq b3lyp/6-311+G(d) scrf=(smd,solvent=water) empiricaldispersion=gd3 nosymm

ch3sh-cn_6311+Gd_aq

-1 1
 C	-1.146613000	 0.040886000	-0.009890000
 H	-0.746237000	-0.238542000	 0.963372000
 H	-0.697187000	-0.573506000	-0.788321000
 H	-0.905795000	 1.085919000	-0.203389000
 C	 2.478293000	 0.625145000	 0.056880000
 N	 2.502997000	-0.540538000	-0.057419000
 H	-3.054295000	-1.422411000	 0.211917000
 S	-2.981783000	-0.094722000	-0.035433000




