%nproc=8
%mem=21200MB
#p opt freq b97d scrf=(solvent=benzene,SMD) gen
pseudo=read scfcyc=300

TS3_insertion  Energy= -939.494458133

+1 1
 C                  1.32191700   -1.28072600   -1.67170300
 C                  2.08416000   -0.36729000   -2.53751500
 O                  1.36790400   -0.04823200   -3.67135300
 O                  3.20783200    0.10151000   -2.32339700
 H                  1.49181400   -2.57890000   -0.06161100
 C                  1.98846500    0.90472800   -4.55385300
 H                  2.14200200    1.87052300   -4.05034800
 H                  2.95857100    0.53185200   -4.91856000
 H                  1.28909200    1.02242200   -5.39231400
 C                  2.27141800   -2.11163900   -0.79687600
 C                  3.13912900   -1.33775500    0.08488400
 C                  2.83009600   -3.36793700   -1.31253800
 C                  4.37779500   -1.82125000    0.49771900
 H                  2.75655900   -0.39095500    0.46421600
 C                  4.05023000   -3.84677100   -0.87022500
 C                  4.82444000   -3.06808400    0.02637000
 H                  4.99893000   -1.23695200    1.17751100
 H                  5.78939400   -3.45245800    0.36490900
 H                  4.43022100   -4.80815500   -1.21915700
 H                  2.19718200   -3.94858900   -1.98196500
 H                  0.63432700   -1.92940500   -2.22571000
 C                 -0.83206900    1.06843600    0.66086700
 N                 -2.16735400    1.33400600    0.78302300
 N                 -0.24433400    1.98722600    1.48770800
 C                 -2.40659900    2.39428300    1.65232100
 C                 -1.18414000    2.80803900    2.10529200
 H                 -3.41026600    2.74421100    1.86356800
 H                 -0.89636500    3.59301900    2.79472900
 C                 -3.16689100    0.60803800    0.03765300
 C                 -3.31846400    0.90129800   -1.33421500
 C                 -3.90235700   -0.39868300    0.70570400
 C                 -4.26194200    0.14262700   -2.05306300
 C                 -2.52342000    1.99377800   -2.04531100
 C                 -4.82804700   -1.12725800   -0.05989000
 C                 -3.63598700   -0.72654800    2.17416500
 H                 -4.40268000    0.34223400   -3.11667600
 C                 -5.00612300   -0.86119300   -1.42485800
 H                 -1.81648300    2.44095300   -1.33278800
 C                 -1.69489300    1.41515500   -3.21141900
 C                 -3.46050400    3.11877200   -2.53677300
 H                 -5.40407100   -1.92363400    0.41059500
 H                 -3.36010600    0.20868100    2.68711700
 C                 -2.43292800   -1.69125800    2.29447100
 C                 -4.86079800   -1.30403300    2.90952900
 H                 -5.72494000   -1.44751200   -2.00108500
 H                 -1.10880500    2.21525400   -3.69232300
 H                 -0.99556600    0.64120500   -2.86274100
 H                 -2.34910100    0.96395000   -3.97538400
 H                 -4.19043900    2.73352600   -3.26748200
 H                 -2.87504500    3.91490400   -3.02674900
 H                 -4.02085800    3.56457100   -1.69826000
 H                 -2.19538000   -1.85797500    3.35933700
 H                 -1.54475900   -1.28893900    1.79307000
 H                 -2.66085200   -2.66040500    1.83060900
 H                 -5.11218500   -2.31091800    2.53957600
 H                 -5.74897200   -0.66099200    2.79414000
 H                 -4.63414300   -1.39559000    3.98410500
 C                  1.18726700    2.07259000    1.62292600
 C                  1.81990300    1.28327900    2.60792500
 C                  1.89527700    2.89196400    0.71536800
 C                  3.22677600    1.31584800    2.65435100
 C                  1.03583400    0.36875300    3.54299000
 C                  3.29966400    2.88056000    0.79581500
 C                  1.18449200    3.72669200   -0.34672800
 H                  3.74738200    0.71030900    3.39789200
 C                  3.96018800    2.10026700    1.75413800
 H                 -0.03211400    0.61881800    3.46329100
 C                  1.20031200   -1.09812500    3.09223700
 C                  1.44883100    0.54668100    5.01845900
 H                  3.87827000    3.48374400    0.09548100
 H                  0.11333900    3.76672000   -0.09937900
 C                  1.31870800    3.06129800   -1.73345200
 C                  1.70125200    5.18064400   -0.38649300
 H                  5.05144700    2.10364100    1.79798000
 H                  0.61565000   -1.76981600    3.74073300
 H                  0.84647300   -1.23307000    2.06223400
 H                  2.25861600   -1.40351200    3.14329100
 H                  2.49601000    0.24469600    5.18240200
 H                  0.81441800   -0.08556700    5.66070100
 H                  1.34002000    1.59440400    5.34363600
 H                  2.37873400    2.96194200   -2.01266900
 H                  0.80811600    3.67284300   -2.49609300
 H                  0.87414100    2.05588000   -1.73304500
 H                  2.75411800    5.22617500   -0.70828900
 H                  1.62345200    5.66277000    0.60176400
 H                  1.10614000    5.76572000   -1.10664300
 Cu                 0.08079900   -0.18670900   -0.49507300

-H -B -C -N -O -F -Si -Cl 0
6-31g(d)
*****
-Cu 0
lanl2dz
F  1  1.0
3.525    1.0000
*****

-Cu 0
lanl2dz




