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

ch3sh-sh_6311+Gd_aq

-1 1
 C	 0.788545000	 0.123070000	-0.002611000
 H	 0.405567000	-0.377105000	 0.885373000
 H	 0.460893000	 1.162011000	 0.009062000
 H	 0.402165000	-0.358122000	-0.899571000
 H	 2.816229000	-1.190160000	-0.020084000
 S	 2.628509000	 0.149148000	-0.005754000
 H	-4.267539000	 0.089791000	-0.003311000
 S	-2.910147000	 0.133652000	-0.002472000




