%mem=3000MB
%nprocshared=4
#p opt=maxstep=4 freq b3lyp/6-311+g(d) scrf=(smd,solvent=water) nosymm
empiricaldispersion=gd3

ch3c6h5-nch33_6311+Gd

0 1 
 C                  0.91670700   -0.46477600    0.30051500
 H                  0.61283400   -0.88513000    1.26975500
 H                  0.36880800    0.47068200    0.15890100
 H                  0.56563100   -1.17526400   -0.45911300
 C                  2.40878000   -0.26610300    0.23229900
 C                  2.96203500    0.98075200    0.02137200
 C                  3.27100100   -1.40618400    0.42982600
 C                  4.38848100    1.18431900   -0.01757200
 H                  2.30031200    1.83843000   -0.09622400
 C                  4.68086000   -1.23520400    0.19683300
 H                  2.84029700   -2.40353600    0.47791000
 C                  5.22141500    0.01881600   -0.01321500
 H                  4.79818000    2.15877000   -0.26661200
 H                  5.33546600   -2.10515600    0.21465500
 H                  6.29539500    0.12351300   -0.15919100
 N                 -3.62473943   -1.38726387    0.52241752
 C                 -3.35394271   -2.58071403    1.32701136
 H                 -3.01399099   -3.39678196    0.68756929
 H                 -2.57080617   -2.37272087    2.05831698
 H                 -4.24929957   -2.92475678    1.87390284
 C                 -4.07552518   -0.29973369    1.39298004
 H                 -3.30456800   -0.06337511    2.12950978
 H                 -4.26979897    0.59892065    0.80344002
 H                 -5.00057584   -0.55637378    1.93820052
 C                 -4.66062114   -1.68720144   -0.46804691
 H                 -4.86375334   -0.80517860   -1.07928114
 H                 -4.32727734   -2.49005384   -1.12914857
 H                 -5.60905032   -2.00293675    0.00059100

