%nprocshared=20
%mem=41GB
#p opt=(calcfc,maxstep=17) freq=noraman b3lyp genecp scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=512)

opt freq

1 1
 C                  2.82849077   -2.22666709   -0.00533416
 C                  1.42345801   -2.02426964    0.01857510
 C                  0.57970930   -3.16943138    0.05230643
 C                  2.50407394   -4.62273169    0.04335576
 H                 -0.49612051   -3.02487707    0.07032257
 H                  2.92242295   -5.62489638    0.05361733
 C                  0.87400910   -0.69339630    0.01364529
 C                  1.73445000    0.45989218    0.00911568
 C                  3.72729905   -1.04266455   -0.05374361
 H                  4.45136284   -1.09077498    0.77700253
 H                  4.37031197   -1.10583720   -0.94803731
 C                  3.11003920    0.31172208   -0.03872784
 H                  5.11638679    0.93191994   -0.15577042
 C                  4.14127481    1.42973959   -0.08736714
 C                  4.02999146    2.30348245   -1.35591278
 H                  4.88631088    2.98534705   -1.39357378
 H                  3.11967532    2.90665771   -1.37910809
 H                  4.04946548    1.68373345   -2.25891509
 C                  4.18974642    2.25908507    1.21531406
 H                  3.29042450    2.85944896    1.37103676
 H                  5.04556926    2.94117198    1.16995933
 H                  4.31895723    1.60974137    2.08777907
 P                 -3.52742245   -0.09967639   -0.02873430
 C                 -4.16292129    0.77910478    1.45319901
 H                 -5.24813572    0.90521228    1.38220949
 H                 -3.68643908    1.76097747    1.52526689
 H                 -3.92104525    0.20402719    2.35142707
 C                 -4.11830611    0.90640349   -1.44693620
 H                 -5.20434224    1.03468267   -1.39396270
 H                 -3.85606847    0.40725866   -2.38404230
 H                 -3.63478975    1.88719819   -1.42406246
 C                 -4.51539906   -1.64529066   -0.11226690
 H                 -4.28658435   -2.27169561    0.75469904
 H                 -4.25601432   -2.19509989   -1.02155817
 H                 -5.58517768   -1.41236573   -0.12027786
 Au                -1.19405841   -0.42934667   -0.00365236
 C                  1.10992510   -4.44658229    0.06596609
 H                  0.45328819   -5.31036920    0.09378394
 C                  3.35394427   -3.52071836    0.00715161
 H                  4.43117549   -3.66271215   -0.01203689
 C                  1.04475321    1.83645283    0.04072433
 C                  0.74389142    2.43798324    1.26306421
 C                  0.72094804    2.48193905   -1.15260961
 C                  0.11875504    3.68441445    1.29196876
 H                  0.99860789    1.92848731    2.20368911
 C                  0.09650953    3.72920023   -1.12386982
 H                  0.95816309    2.00806312   -2.11609269
 C                 -0.20473884    4.33043253    0.09813925
 H                 -0.11898558    4.15832555    2.25539192
 H                 -0.15830693    4.23808747   -2.06492060
 H                 -0.69758109    5.31322040    0.12117936

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

Au 0
SDD









