%nprocshared=20
%mem=41GB
#p opt=modredundant b3lyp genecp scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

opt freq

1 1
 C                 -0.74536082    0.97684676   -0.27929216
 C                 -0.09931338    2.10607897    0.04342936
 C                  0.57659402    4.49196183    0.05803007
 H                  0.46793354    4.92189592    1.05886112
 H                  0.67891725    5.30455754   -0.65986173
 C                 -0.61664777    3.53466224   -0.24404028
 H                 -0.82232323    3.58440454   -1.33097143
 C                 -1.92076264    3.82956966    0.37867124
 C                  1.27576654    2.24951566    0.65578760
 H                  1.92605178    1.39395091    0.46376345
 H                  1.21566933    2.39139764    1.74316846
 C                  1.81494087    3.55871463    0.04025864
 O                  3.48267689    5.21872574    0.19595380
 O                  1.54815944    3.71153836   -2.34137640
 C                  4.57154064    5.89795921    0.85952127
 H                  5.40222832    5.20692429    1.02135800
 H                  4.86493818    6.70272147    0.18664987
 H                  4.23717086    6.29841968    1.81970585
 C                  1.94577446    3.37548597   -3.69016705
 H                  2.94041418    3.77561325   -3.89891619
 H                  1.95276089    2.29040670   -3.81816494
 H                  1.19909995    3.83665291   -4.33514275
 H                 -1.72783231    1.11472143   -0.74887063
 C                  2.96041441    4.16795748    0.84759468
 C                  2.33672077    3.23901952   -1.36547862
 O                  3.33855717    2.58057782   -1.55732024
 O                  3.32261504    3.78943450    1.94056836
 H                 -2.46171675    2.94727416    0.72161448
 C                 -2.58045010    5.04724430    0.55972485
 C                 -3.84143161    5.01379619    1.24010860
 C                 -2.07333448    6.30723482    0.10595275
 C                 -4.54531722    6.18011520    1.47266843
 H                 -4.23313693    4.05905370    1.57685751
 C                 -2.79144007    7.46227128    0.33629796
 H                 -1.13803016    6.35242354   -0.43528530
 C                 -4.01976676    7.40053447    1.02199840
 H                 -5.49601147    6.15453567    1.99334760
 H                 -2.41482707    8.41792823   -0.01131359
 H                 -4.57395497    8.31724369    1.20001271
 Au                -0.03676817   -0.99062850    0.00184401
 P                  0.72456544   -3.21206037    0.27945501
 C                 -0.56696161   -4.52455317    0.10200042
 C                  2.06322382   -3.59021733   -1.02403111
 C                  1.35639328   -3.34073895    2.09078163
 C                 -0.22860610   -5.85338019    0.42936237
 C                 -1.90809231   -4.24238838   -0.25743382
 C                  2.57770100   -5.04105361   -1.04756770
 C                  3.24251701   -2.62218197   -0.80308110
 C                  1.41345087   -3.28874108   -2.39242898
 C                  2.06313828   -2.01514983    2.46354949
 C                  0.09577838   -3.47450802    2.97304515
 C                  2.32753089   -4.49775985    2.38796390
 C                 -1.16944451   -6.87924269    0.42672480
 H                  0.78865872   -6.09903726    0.70050269
 C                 -2.84713102   -5.29027294   -0.24025747
 C                 -2.44894932   -2.91787099   -0.69830584
 H                  1.78662122   -5.74721272   -1.31305233
 H                  3.35742347   -5.11969396   -1.81535681
 H                  3.02111103   -5.35249856   -0.09939488
 H                  3.93638208   -2.70832736   -1.64828671
 H                  2.90843096   -1.58003112   -0.74592189
 H                  3.80302875   -2.85864410    0.10601747
 H                  0.55334351   -3.93930042   -2.58228192
 H                  1.08410236   -2.24796140   -2.46838963
 H                  2.15047851   -3.47061169   -3.18427555
 H                  2.92101634   -1.79891864    1.82220873
 H                  1.37957337   -1.16155895    2.41528014
 H                  2.42970605   -2.09542051    3.49469982
 H                  0.38895643   -3.37912929    4.02568701
 H                 -0.63196423   -2.68336367    2.75605628
 H                 -0.39808161   -4.44157293    2.84436092
 H                  2.57134367   -4.47926227    3.45756750
 H                  1.90346761   -5.48119725    2.17635154
 H                  3.26857531   -4.39537435    1.84032320
 C                 -2.49431735   -6.59342082    0.09829024
 H                 -0.86711017   -7.88940400    0.68630111
 H                 -3.87358388   -5.06332166   -0.51338413
 C                 -2.22399168   -2.46649928   -2.00488395
 C                 -3.32516709   -2.21102959    0.13858830
 H                 -3.24571007   -7.37775589    0.09813185
 C                 -2.85849449   -1.31488039   -2.49213243
 H                 -1.56799812   -3.04467700   -2.64272620
 C                 -3.97916386   -1.05727608   -0.31216183
 H                 -3.49734664   -2.59356219    1.13822067
 C                 -3.72530812   -0.63522127   -1.62617800
 H                 -2.75745833   -0.99857854   -3.50930736
 H                 -4.69224594   -0.52376814    0.28095133
 H                 -4.24862866    0.23862380   -1.99720147

1 F
2 F
3 F
4 F
5 F
6 F
7 F
8 F
9 F
10 F
11 F
12 F
13 F
14 F
15 F
16 F
17 F
18 F
19 F
20 F
21 F
22 F
23 F
24 F
25 F
26 F
27 F
28 F
29 F
30 F
31 F
32 F
33 F
34 F
35 F
36 F
37 F
38 F
39 F

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

Au 0
SDD



