%mem=3000MB
%nprocshared=4
#p opt=(maxstep=4) freq=noraman b3lyp/6-311+G(d) scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3 scf=(maxcyc=1000,conver=8,nosym)

ch3nh2-sh_6311+Gd_ch2cl2

-1 1
 N	-4.698520000	 2.001288000	-0.160253000
 H	-4.151199000	 1.146314000	-0.210733000
 H	-4.418927000	 2.552698000	-0.966964000
 C	-4.336236000	 2.730209000	 1.067090000
 H	-4.900030000	 3.662928000	 1.118403000
 H	-4.608144000	 2.134608000	 1.939903000
 H	-3.270389000	 2.976238000	 1.146183000
 H	-3.280176000	 5.266783000	 5.416561000
 S	-3.559722000	 4.599761000	 4.268092000




