%mem=3000MB
%nprocshared=4
#p opt=maxstep=1 freq=noraman b3lyp/6-311+g(d)
scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3
scf=(maxcyc=1000,conver=8,nosym)

ch3nh2-Ts_6311+Gd_ch2cl2

-1 1
 N                  6.20489600    0.08617000    0.02580500
 H                  6.56746900   -0.70225000   -0.50320200
 H                  6.50807800   -0.05689800    0.98526800
 C                  4.73346500    0.09180300   -0.03498100
 H                  4.34726400    0.93064300    0.54781600
 H                  4.41055700    0.23684800   -1.06799700
 H                  4.26171600   -0.82480300    0.34144400
 C                 -3.02597700    1.21466700    0.00151700
 C                 -1.63108600    1.20839400   -0.03498500
 C                 -0.94492300   -0.00333000   -0.04865200
 C                 -1.65299500   -1.20551100   -0.02166600
 C                 -3.04479600   -1.18788500    0.01521100
 C                 -3.75525700    0.02072400    0.02672300
 H                 -3.55312900    2.16466300    0.00943600
 H                 -1.07732900    2.14004800   -0.06004800
 H                 -1.11802800   -2.14869400   -0.03680900
 H                 -3.58918700   -2.12817700    0.03402500
 C                 -5.26317700    0.02629900    0.03393500
 H                 -5.65926700   -0.13537000   -0.97517800
 H                 -5.66410900   -0.76965000    0.66767000
 H                 -5.66104700    0.97894300    0.39211900
 S                  0.87126900   -0.02750200   -0.01157900
 O                  1.26716900   -1.20299400   -0.83794700
 O                  1.22926800   -0.18050100    1.42950200
 O                  1.29867600    1.27856600   -0.58562100

