%mem=40000MB
%nprocshared=20
#p opt freq b3lyp/6-311+G(d) scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3 scf=(maxcyc=1000,conver=8,nosym)

ch3oTs-cn_6311+Gd_ch2cl2

-1 1
 C	 2.773808000	 0.821319000	-4.596678000
 C	 2.628315000	 1.077407000	-3.237867000
 C	 1.376050000	 0.887297000	-2.654935000
 C	 0.278906000	 0.444462000	-3.393799000
 C	 0.449602000	 0.194602000	-4.750181000
 C	 1.692723000	 0.380046000	-5.371714000
 H	 3.743054000	 0.967298000	-5.061641000
 H	 3.470297000	 1.419930000	-2.648825000
 H	-0.686677000	 0.300134000	-2.924489000
 H	-0.396598000	-0.149242000	-5.335609000
 C	 1.853328000	 0.139362000	-6.847330000
 H	 1.193792000	-0.658139000	-7.196322000
 H	 1.595556000	 1.044031000	-7.408885000
 H	 2.882773000	-0.120954000	-7.101562000
 S	 1.180318000	 1.185341000	-0.919138000
 O	-0.217061000	 1.502109000	-0.602712000
 O	 2.208016000	 2.115424000	-0.437653000
 O	 1.516977000	-0.302960000	-0.355930000
 C	 1.415408000	-0.493737000	 1.094987000
 H	 2.118066000	 0.160175000	 1.609405000
 H	 0.393597000	-0.314018000	 1.424659000
 H	 1.685044000	-1.534204000	 1.249106000
 C	 1.050730000	-1.256946000	 4.295194000
 N	 1.707883000	-0.422951000	 4.796445000




