%mem=40000MB
%nprocshared=20
#p opt=(maxstep=3) freq b3lyp/6-311+g(d) scrf=(smd,solvent=dichloromethane) nosymm
empiricaldispersion=gd3

ch3cn_sch3_6311+Gd

-1 1
 C                 -0.67395000    0.07546600    0.00561200
 H                 -0.45796400   -0.84181600   -0.54445300
 H                 -0.09352900    0.88942100   -0.43191100
 H                 -0.36224900   -0.05794200    1.04289300
 C                 -2.09292300    0.37866600   -0.05874600
 N                 -3.22067400    0.61946100   -0.11012500
 C                  4.64745100   -1.13297900    0.18722200
 H                  4.80994496   -2.13093514    0.61002608
 H                  5.09563465   -1.12751503   -0.81293994
 H                  5.21501944   -0.42430306    0.80100546
 S                  2.84490900   -0.69954900    0.13156600

