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

Direct TS

0 1
 P                  0.20862316    0.06360220   -3.26028950
 Au                -0.24973335   -0.03583074   -0.94632479
 C                 -1.14597266   -0.56439729   -4.33240912
 H                 -2.05273080    0.02092681   -4.15471742
 H                 -0.86508422   -0.48927171   -5.38812557
 H                 -1.35010350   -1.61000959   -4.08448205
 C                  1.67919304   -0.91255621   -3.77185142
 H                  1.52708367   -1.96333926   -3.50879870
 H                  1.84098969   -0.82797650   -4.85153083
 H                  2.56188677   -0.54424677   -3.24121302
 C                  0.54172052    1.75562693   -3.89541554
 H                  1.40466651    2.17680249   -3.37175304
 H                  0.74552188    1.72932095   -4.97106930
 H                 -0.32683692    2.39284933   -3.70567067
 C                 -0.58869777   -0.12961160    1.07515446
 C                  0.03942411   -1.24175340    1.89040887
 H                  1.00398566   -1.54350989    1.47616313
 C                 -1.37710585    0.75310438    1.76466956
 H                 -1.92559215    1.54781037    1.26933547
 N                 -0.87497175   -0.18324893    3.92025589
 C                 -1.01699410   -0.23870843    5.37407047
 H                 -0.10323978    0.17703394    5.80518444
 H                 -1.88156692    0.34844172    5.68786545
 H                 -1.14357165   -1.27858647    5.68757887
 C                  0.26391660   -0.86542222    3.33368503
 H                  0.53215996   -1.71161678    3.94554024
 C                  1.77323839    0.29594035    3.45531411
 O                  1.56970938    1.29327395    4.18039610
 O                  2.71433163   -0.18570746    2.78560372
 C                 -1.58908957    0.61557338    3.17372731
 H                 -2.36823973    1.18663759    3.67187605
 H                 -0.62506309   -2.11923575    1.82390599

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

Au 0
SDD





