%nproc=24
%mem=122200MB
#p b3lyp/gen opt=(ts,calcfc,noeigentest) freq empiricaldispersion=GD3 nosymm scrf=(SMD,solvent=dichloromethane) pseudo=(read)

Title Card Required

0 1
 29       1.258954       0.359911       0.088597
 7       1.299309       1.980954       1.713736
 6       0.429178       2.903556       2.169845
 6       1.974667       2.612916       3.748661
 6       0.811806       3.332347       3.467801
 1       2.632228       2.614105       4.614686
 1       0.319694       4.072280       4.093966
 7       1.832277      -1.022573       1.635102
 6       1.633096      -2.343836       1.827402
 6       2.533281      -2.830155       2.808351
 6       3.279318      -1.715649       3.190155
 1       2.609207      -3.845886       3.186596
 1       4.079728      -1.596669       3.916088
 7       3.358253       0.798879      -0.089223
 6       4.162508       1.135698      -1.119418
 6       5.390602       1.643566      -0.623468
 6       5.269626       1.574249       0.764015
 1       6.243364       1.987804      -1.201772
 1       5.959622       1.836925       1.561929
 7       2.241451       1.814150       2.678332
 7       4.042794       1.065052       1.057382
 7       2.840089      -0.647203       2.472510
 1       4.238391       0.930017       3.325429
 6      -0.360832       0.676416      -0.942701
 6      -1.462586      -0.286112      -1.275882
 8      -2.436437      -0.210943      -0.486212
 6      -2.576306      -2.054559      -2.523856
 1      -2.233850      -2.916965      -3.112166
 7       0.170616       1.487248      -2.516510
 7       0.658934       2.342274      -3.054892
 5       3.402105       0.804754       2.457498
 6      -3.681841      -1.293631      -3.272985
 1      -4.541471      -1.964154      -3.443906
 1      -4.025930      -0.433627      -2.678390
 1      -3.322764      -0.928504      -4.247747
 6      -0.673745       3.364905       1.290284
 6      -2.024964       3.110575       1.631765
 6      -0.358196       4.020237       0.066991
 6      -3.042074       3.506376       0.740108
 6      -1.403528       4.397292      -0.794678
 6      -2.753745       4.145830      -0.478577
 1      -4.083022       3.290139       0.997370
 1      -1.156392       4.895219      -1.737385
 6       0.566843      -3.071687       1.098547
 6      -0.792434      -2.718743       1.307279
 6       0.902505      -4.134536       0.216954
 6      -1.793945      -3.449014       0.639511
 6      -0.130731      -4.827328      -0.440488
 6      -1.486372      -4.505068      -0.235482
 1      -2.840026      -3.176778       0.801173
 1       0.130516      -5.637969      -1.128293
 6       3.739855       0.903847      -2.519971
 6       3.354209      -0.399840      -2.938638
 6       3.739547       1.975781      -3.452197
 6       2.996007      -0.603971      -4.284430
 6       3.358009       1.727149      -4.784272
 6       2.986340       0.443270      -5.223180
 1       2.716315      -1.610975      -4.604418
 1       3.343049       2.561266      -5.492293
 6       3.316737      -1.578896      -1.985762
 1       4.192418      -1.592458      -1.318043
 1       2.428798      -1.535501      -1.334154
 1       3.279165      -2.524866      -2.547991
 6       4.104808       3.389305      -3.039950
 1       3.682338       3.641508      -2.054908
 1       5.197997       3.522563      -2.965199
 1       3.729774       4.113501      -3.780544
 6       2.551520       0.204732      -6.654569
 1       3.116277       0.842270      -7.354718
 1       2.695434      -0.848352      -6.945757
 1       1.480074       0.441269      -6.786077
 6       1.079944       4.289668      -0.334068
 1       1.634810       4.786891       0.479483
 1       1.614839       3.351406      -0.545624
 1       1.119701       4.928336      -1.230262
 6      -2.385361       2.382678       2.912371
 1      -1.829533       1.434177       2.996348
 1      -2.135321       2.982685       3.803531
 1      -3.463404       2.158436       2.940668
 6      -3.857389       4.550515      -1.435708
 1      -4.848796       4.282588      -1.036875
 1      -3.843275       5.638610      -1.623219
 1      -3.736015       4.053463      -2.414325
 6       2.345401      -4.535030      -0.029054
 1       2.429767      -5.122538      -0.957499
 1       3.001925      -3.655550      -0.107917
 1       2.735509      -5.156060       0.796419
 6      -1.179071      -1.576716       2.225512
 1      -0.623823      -1.621153       3.177186
 1      -0.945899      -0.607129       1.760225
 1      -2.258573      -1.599893       2.439544
 6      -2.579565      -5.276200      -0.947697
 1      -2.421406      -5.274852      -2.039828
 1      -2.595921      -6.332457      -0.624903
 1      -3.570632      -4.841555      -0.743049
 1      -0.844437       1.618955      -0.645380
 7      -1.385695      -1.217915      -2.261912
 6      -0.200660      -1.459713      -3.099308
 1       0.651374      -0.919077      -2.674413
 6      -0.428388      -1.075489      -4.568977
 1       0.479402      -1.290693      -5.150822
 1      -1.259612      -1.655989      -4.998237
 1      -0.663524      -0.004097      -4.667632
 1       0.033609      -2.535337      -3.030387
 1      -2.955063      -2.427755      -1.564718

-H -B -C -N -O 0
6-31+g(d,p)
****
-Cu 0
SDD
*****

-Cu 0
SDD





