%nprocshared=20
%mem=41GB
#p opt freq=noraman bp86 genecp scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

opt freq

1 1
 Au                 0.02801837   -0.25602798    0.35543363
 C                  0.07575589    1.68683612    0.91749394
 C                 -0.36899660    2.75209909    0.16104182
 C                  0.70191345    4.12217115   -0.01987893
 H                  1.68839281    4.07672922    0.45214862
 C                 -0.50963815    4.20547361    0.76715444
 H                 -1.38997876    4.71331995    0.35131669
 C                 -0.60262821    2.84221277   -1.35288933
 H                 -1.63144602    3.13270192   -1.62368632
 H                 -0.33225703    1.91144912   -1.87389865
 C                  0.46026590    3.98165325   -1.51956292
 P                 -0.00922945   -2.51326283   -0.30453835
 C                  0.10851294   -3.70177992    1.09753059
 C                 -1.53547886   -3.00058746   -1.21161176
 H                  0.48233280    1.96384930    1.90591255
 C                  1.37636552   -2.96455224   -1.43067397
 H                  2.33562737   -2.78793898   -0.91763013
 H                  1.30115929   -4.02624416   -1.72182700
 H                  1.33275541   -2.33170840   -2.33207287
 H                  1.06846325   -3.55469431    1.61896664
 H                  0.04322995   -4.73911577    0.72681208
 H                 -0.71420387   -3.51131272    1.80568454
 H                 -2.41440415   -2.81337972   -0.57350826
 H                 -1.49277884   -4.07100125   -1.47625357
 H                 -1.62461202   -2.39597799   -2.12887045
 H                 -0.40784126    4.26061389    1.85526573
 H                  1.36357688    3.64731494   -2.04895057
 H                  0.08054322    4.90938989   -1.98221370

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

Au 0
SDD


