%nprocshared=20
%mem=41GB
#p opt=(calcfc,maxstep=9) freq=noraman b3lyp genecp scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=512)

opt freq

1 1
 C                  3.07111108   -1.59953737   -0.69026212
 C                  1.92156055   -1.10333988   -0.05153381
 C                  1.06602633   -1.97544792    0.63218078
 C                  2.46846560   -3.83808805   -0.05174517
 H                  0.20495290   -1.59527304    1.17263298
 H                  2.67407363   -4.90463822   -0.04826351
 C                  1.83294470    0.36264385   -0.22847683
 C                  0.68753429    1.10396203   -0.22846781
 C                  3.89927176   -0.47941546   -1.27968408
 H                  3.84019090   -0.46922471   -2.37405764
 H                  4.95824886   -0.55499368   -1.01353059
 C                  3.26042973    0.81775263   -0.72826319
 H                  3.19244152    1.63408076   -1.44650851
 C                  3.64916096    1.27376191    0.60569585
 C                  4.20240312    0.35026636    1.62709044
 H                  5.29260181    0.34080010    1.45563731
 H                  4.03619432    0.71872978    2.64237094
 H                  3.85920733   -0.67984168    1.52598288
 C                  3.59560864    2.71017957    0.97993315
 H                  2.74172035    2.89666747    1.64627483
 H                  4.49090821    2.94410663    1.57009022
 H                  3.52093381    3.37725347    0.12211810
 P                 -3.44597623   -0.40669871    0.10134022
 C                 -4.63929602    0.75547263    0.87162316
 H                 -5.63618369    0.30436226    0.91046971
 H                 -4.30937304    0.99857561    1.88547253
 H                 -4.67938257    1.67723569    0.28424380
 C                 -3.57443299   -1.94495148    1.09506501
 H                 -4.61204270   -2.29243792    1.12896142
 H                 -2.94583495   -2.71939914    0.64635574
 H                 -3.22231020   -1.75193547    2.11248469
 C                 -4.19126047   -0.83408399   -1.52107976
 H                 -4.21375217    0.05547250   -2.15653979
 H                 -3.58310329   -1.60031090   -2.01012367
 H                 -5.21055511   -1.20913103   -1.38293718
 Au                -1.25596394    0.40746955   -0.05582152
 C                  1.34232774   -3.34427951    0.61829527
 H                  0.68414202   -4.02866077    1.14581459
 C                  3.34585956   -2.96357023   -0.70247040
 H                  4.23531378   -3.34191573   -1.19857296
 Cl                 0.82153623    2.84487727   -0.55388131

C H P Cl 0
6-31G*
****
Au 0
SDD
****

Au 0
SDD



