%nprocshared=24
%mem=41GB
#p opt=(calcfc,ts,noeigentest,maxstep=10) freq b3lyp genecp empiricaldispersion=gd3 scrf=(pcm,solvent=dichloromethane) nosymm scf=maxcyc=512

Direct TS

1 1
 P                 -1.69194665    0.41376836   -3.22501612
 Au                -0.64586436   -0.20796973   -1.21862730
 C                 -2.59723645    2.00858426   -3.12260846
 H                 -1.89855716    2.80625103   -2.85482519
 H                 -3.06597867    2.24240736   -4.08419014
 H                 -3.36684882    1.94169864   -2.34837612
 C                 -2.94672990   -0.79090121   -3.81642949
 H                 -3.71974129   -0.91505962   -3.05283093
 H                 -3.40579903   -0.43637795   -4.74514266
 H                 -2.46853175   -1.75860849   -3.99299149
 C                 -0.54814196    0.62594318   -4.64572640
 H                 -0.02070628   -0.31343176   -4.83410745
 H                 -1.10568105    0.91743845   -5.54198846
 H                  0.18708438    1.39979010   -4.40760701
 C                  0.30450309   -0.72813925    0.58299611
 C                 -0.71917142   -1.14010338    1.54235694
 H                 -1.25022599   -2.03903290    1.22230210
 C                  1.62705890   -0.64610479    0.74723102
 H                  2.11466690   -0.91553512    1.68516958
 C                  0.04300651   -2.13028075    3.08681954
 H                  0.66759980   -2.82884488    2.53669355
 H                 -0.91014344   -2.53272728    3.41833922
 C                  0.69151003   -1.20357660    3.90398749
 C                  0.07643486   -0.33280624    4.85619039
 C                  0.81534543    0.78632707    5.31883201
 C                 -1.26360336   -0.49374625    5.29029677
 C                  0.22109708    1.73262952    6.14132061
 H                  1.84484025    0.91139431    4.99540384
 C                 -1.84993958    0.45361415    6.11448668
 H                 -1.83615433   -1.35843149    4.97758416
 C                 -1.11461176    1.57168826    6.53171040
 H                  0.78654864    2.59625333    6.47622795
 H                 -2.88002087    0.33140848    6.43246225
 H                 -1.58156480    2.31415760    7.17212435
 H                  1.75218074   -1.03492406    3.73230871
 H                 -1.38127556   -0.40752164    1.95447597
 C                  2.56482212   -0.17586646   -0.38018907
 C                  2.87932197    1.17746381   -0.50691102
 C                  3.09985965   -1.10288790   -1.27456832
 C                  3.72813884    1.60367296   -1.52822263
 H                  2.45673339    1.90815734    0.19789225
 C                  3.94973634   -0.67683826   -2.29564677
 H                  2.85223132   -2.16958430   -1.17472839
 C                  4.26382778    0.67621162   -2.42268860
 H                  3.97557706    2.67044612   -1.62855146
 H                  4.37176833   -1.40803337   -3.00042825
 H                  4.93311293    1.01249057   -3.22784087

-C -H -N -P -O -Si 0
6-31G(d)
****
Au 0
SDD
****

Au
SDD



