%nprocshared=12
%mem=20GB
#p wb97xd/genecp scrf=(solvent=dichloromethane,pcm) nosymm scf=yqc

TS34_CH transition state ATS3 C-H insertion

1 1 
29                 -0.306064   -0.247408    0.039370
 6                 -2.217610   -0.971703   -0.303064
15                  1.694194    0.513483    0.620976
 6                 -3.260290   -0.972351    0.868398
 6                 -2.500595    0.075722   -1.327039
 6                 -1.868380   -2.364400   -0.776022
 7                  2.179443    2.041744    0.132847
 7                  3.059008   -0.200494   -0.044679
 8                  1.897405    0.519525    2.242864
 6                 -3.041288   -1.642428    2.079817
 6                 -4.679066   -0.638270    0.843124
 1                 -2.230473   -0.243648    0.892387
 8                 -2.835982    1.241765   -0.747438
 8                 -2.379056   -0.061830   -2.528224
 6                 -0.858491   -3.107665   -0.154179
 6                 -2.581715   -2.950311   -1.828372
 6                  1.265254    3.083370   -0.251425
 6                  3.535475    2.020713   -0.280048
 6                  3.199302   -1.618611   -0.216859
 6                  4.024825    0.776465   -0.368552
 6                  1.140934   -0.388899    3.060029
 7                 -4.184517   -1.713907    2.770896
 1                 -2.117576   -2.042702    2.475369
 6                 -5.533245   -0.030887   -0.084463
 6                 -5.214319   -1.109789    2.055432
 6                 -3.093628    2.361731   -1.615000
 6                 -0.551758   -4.398026   -0.580951
 1                 -0.294912   -2.687182    0.677856
 6                 -2.271186   -4.235987   -2.257754
 1                 -3.372129   -2.393330   -2.318094
 6                  0.679418    3.886808    0.743674
 6                  0.974117    3.268002   -1.616785
 1                  4.043647    2.954859   -0.467465
 6                  3.844693   -2.371139    0.780668
 6                  2.654287   -2.217361   -1.371341
 1                  5.026483    0.471986   -0.633795
 6                  1.541149   -0.158852    4.500150
 1                  1.351828   -1.420351    2.754819
 1                  0.068641   -0.197633    2.919140
 1                 -4.272443   -2.115675    3.693477
 6                 -6.873961    0.106025    0.240416
 1                 -5.168088    0.321430   -1.041513
 6                 -6.558292   -0.970807    2.397156
 6                 -3.641874    3.472550   -0.747818
 1                 -3.803638    2.054451   -2.387952
 1                 -2.155472    2.649548   -2.097950
 6                 -1.253816   -4.962873   -1.639819
 1                  0.248577   -4.946352   -0.094858
 1                 -2.828864   -4.673575   -3.080096
 6                  0.921166    3.643943    2.223147
 6                 -0.194565    4.898475    0.340777
 6                  1.542114    2.373913   -2.708038
 6                  0.117322    4.312799   -1.969661
 6                  4.479376   -1.717189    1.998437
 6                  3.940422   -3.752782    0.596486
 6                  2.029926   -1.384994   -2.481809
 6                  2.762482   -3.601923   -1.499071
 1                  2.609369   -0.350423    4.635304
 1                  0.980275   -0.833392    5.153999
 1                  1.329973    0.872912    4.795360
 6                 -7.380102   -0.350484    1.469751
 1                 -7.547920    0.573876   -0.469782
 1                 -6.942462   -1.337361    3.343085
 1                 -3.840106    4.353779   -1.365159
 1                 -2.918490    3.751298    0.024112
 1                 -4.575783    3.163372   -0.268347
 1                 -1.012347   -5.963791   -1.983477
 6                 -0.295128    2.929641    2.832521
 6                  1.246515    4.928501    2.994251
 1                  1.780766    2.977327    2.320691
 6                 -0.464508    5.122126   -1.002897
 1                 -0.668995    5.524663    1.090401
 6                  2.540778    3.135246   -3.589375
 6                  0.428003    1.742730   -3.551332
 1                  2.091316    1.558046   -2.233690
 1                 -0.107568    4.487828   -3.018019
 6                  4.215399   -2.488760    3.297838
 6                  5.991125   -1.546632    1.780578
 1                  4.043762   -0.720991    2.114837
 6                  3.399109   -4.363783   -0.526206
 1                  4.444524   -4.359889    1.342083
 6                  0.973710   -2.128121   -3.304162
 6                  3.134067   -0.832436   -3.397923
 1                  1.527710   -0.526319   -2.021206
 1                  2.342389   -4.095837   -2.368419
 1                 -8.434145   -0.222639    1.693294
 1                 -0.111075    2.675032    3.882204
 1                 -1.185744    3.567601    2.786161
 1                 -0.523560    2.004023    2.290451
 1                  1.507074    4.683132    4.029451
 1                  0.395549    5.617910    3.024908
 1                  2.094541    5.454586    2.544137
 1                 -1.138380    5.921367   -1.296255
 1                  2.977385    2.461510   -4.334806
 1                  2.050640    3.958025   -4.122569
 1                  3.355064    3.556521   -2.991008
 1                 -0.158150    2.499747   -4.084164
 1                 -0.263649    1.157211   -2.937273
 1                  0.857819    1.073623   -4.304551
 1                  3.148575   -2.690335    3.442324
 1                  4.743107   -3.448537    3.317912
 1                  4.571858   -1.905335    4.153408
 1                  6.446076   -1.041465    2.639533
 1                  6.476631   -2.522374    1.661511
 1                  6.204390   -0.954353    0.885262
 1                  3.476371   -5.440178   -0.647768
 1                  0.453199   -1.416724   -3.953344
 1                  1.423952   -2.890548   -3.949844
 1                  0.229323   -2.612418   -2.666219
 1                  2.699640   -0.237458   -4.208484
 1                  3.698887   -1.656991   -3.847895
 1                  3.835005   -0.196216   -2.848868

-C -N -O -P -H 0 
cc-pVTZ 
****
-Cu 0
cc-pVTZ 
F  1  1.0 
3.525    1.000
****




