%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                  0.49893953   -1.05791368   -1.18465153
 C                 -0.24689753   -2.26141514   -1.46474176
 C                 -0.27821008   -4.63323059   -0.97389993
 H                  0.18400909   -5.23206936   -0.18672515
 H                 -0.41914858   -5.27476221   -1.84934481
 C                  0.56659709   -3.44134367   -1.36333482
 H                  1.45553396   -3.58472104   -1.97031381
 C                  0.98320111   -2.29090448   -0.20900485
 C                 -1.65559350   -2.57215205   -1.06569030
 H                 -2.24504944   -2.55259664   -1.99440653
 H                 -2.08861180   -1.82911599   -0.39279397
 C                 -1.63613654   -4.02092682   -0.50040187
 O                 -2.94044941   -3.59762382    1.41998235
 O                 -2.84337298   -6.03754175   -0.42343096
 C                 -3.15119230   -3.47611430    2.84672561
 H                 -2.48088807   -2.71879539    3.26000570
 H                 -4.19180474   -3.17643799    2.95949413
 H                 -2.96754059   -4.43607258    3.33415137
 C                 -3.89406288   -6.94017561   -0.84071266
 H                 -4.87071874   -6.48877709   -0.65150091
 H                 -3.79298103   -7.16683894   -1.90454543
 H                 -3.75914883   -7.83767138   -0.23904794
 H                  1.35660142   -0.91367241   -1.84388190
 C                 -1.71638273   -3.97002565    1.03391983
 C                 -2.81249266   -4.84755823   -1.03277049
 O                 -3.57625513   -4.49265735   -1.90440387
 O                 -0.79136339   -4.18691240    1.79021869
 H                  0.39565811   -2.38926263    0.69628031
 C                  2.46317605   -2.34893485    0.09109030
 C                  2.82209425   -2.75643944    1.37966356
 C                  3.47603990   -2.05374375   -0.83186978
 C                  4.16298631   -2.85202595    1.75941101
 H                  2.04948461   -3.01068818    2.09997493
 C                  4.81179000   -2.14848421   -0.46642546
 H                  3.23530172   -1.75260434   -1.84732335
 C                  5.16879576   -2.54501208    0.83376104
 H                  4.40341526   -3.16567885    2.76801015
 H                  5.60070164   -1.91854278   -1.17506889
 O                  6.50227793   -2.60007682    1.08768032
 C                  6.92928005   -3.00130864    2.38887930
 H                  8.01938802   -2.97175706    2.36622833
 H                  6.56122129   -2.31240828    3.15925764
 H                  6.59642432   -4.02043676    2.62128207
 Au                -0.33510429    0.70936627   -0.38891758
 P                 -1.24924032    2.71691949    0.46286974
 C                 -0.19559000    4.22309773    0.25450057
 C                 -2.89958057    3.08484333   -0.41752456
 C                 -1.42942703    2.46237644    2.36008067
 C                 -0.59023040    5.41667730    0.89251179
 C                  1.03988148    4.20935670   -0.43894221
 C                 -3.56329444    4.42539864   -0.05343393
 C                 -3.87306091    1.92514932   -0.12754246
 C                 -2.57448948    3.10423739   -1.92734084
 C                 -1.87061801    1.00240656    2.62365107
 C                 -0.01453741    2.64790733    2.95092638
 C                 -2.42169149    3.39614712    3.07674411
 C                  0.20046859    6.56213224    0.87502411
 H                 -1.53125813    5.45819826    1.42301627
 C                  1.83122512    5.37292443   -0.43292856
 C                  1.60133646    3.06874602   -1.22952197
 H                 -2.94530057    5.27709174   -0.34949548
 H                 -4.51079638    4.50285135   -0.60105853
 H                 -3.79346220    4.51306773    1.01051111
 H                 -4.75763179    2.03518212   -0.76681503
 H                 -3.42063072    0.95048663   -0.34271361
 H                 -4.21717542    1.92783628    0.91078598
 H                 -1.86529691    3.90041708   -2.17674027
 H                 -2.15931723    2.15101191   -2.26859734
 H                 -3.49830673    3.29271755   -2.48800524
 H                 -2.82947490    0.76039107    2.15883860
 H                 -1.12846019    0.28173525    2.26582019
 H                 -1.98060810    0.86329334    3.70653427
 H                 -0.02892181    2.34527999    4.00511571
 H                  0.72193644    2.02132624    2.43362061
 H                  0.32141269    3.68726816    2.90054331
 H                 -2.39298929    3.17344166    4.15071672
 H                 -2.17507284    4.45376911    2.96550765
 H                 -3.45049273    3.23782389    2.74139430
 C                  1.42826822    6.53748398    0.21415198
 H                 -0.14037126    7.46089425    1.38026349
 H                  2.77852279    5.35137319   -0.96384587
 C                  1.11580070    2.79827164   -2.51505196
 C                  2.72900326    2.38229265   -0.75526097
 H                  2.06414366    7.41787372    0.19547339
 C                  1.73675957    1.84796004   -3.33818555
 H                  0.26331177    3.36176339   -2.87170225
 C                  3.37789932    1.42717344   -1.54817700
 H                  3.09637791    2.62553344    0.23524983
 C                  2.85942918    1.18204368   -2.82892351
 H                  1.42620545    1.68298138   -4.34874885
 H                  4.26943951    0.92300665   -1.23854509
 H                  3.37061317    0.46756328   -3.46401145

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
40 F
41 F
42 F
43 F

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

Au 0
SDD


