%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                  1.25298677    1.00682847   -0.01358760
 C                  2.47034611    0.46184577    0.19420860
 C                  4.85599547   -0.06310758   -0.26034013
 H                  5.54005473    0.04728986    0.58426473
 H                  5.45821570   -0.09729258   -1.16950331
 C                  3.83551394    1.09628534   -0.31091527
 H                  3.73118823    1.55170058   -1.29296146
 C                  3.80746169    2.01202150    0.80725059
 C                  2.81932055   -0.88909843    0.77910123
 H                  1.97293175   -1.57449588    0.72213370
 H                  3.11455131   -0.79673051    1.83217873
 C                  4.03212666   -1.36017612   -0.05449516
 O                  4.18711213   -3.60655257    0.64527367
 O                  4.60549272   -2.31543768   -2.13800381
 C                  4.81993374   -4.70527010    1.33915747
 H                  4.91107685   -4.47557590    2.40344965
 H                  4.16511838   -5.56150188    1.18338044
 H                  5.81074131   -4.89337479    0.91883080
 C                  4.29850279   -2.87991191   -3.43203375
 H                  3.67657142   -3.77067974   -3.31518867
 H                  3.77403978   -2.14557849   -4.04822010
 H                  5.26118565   -3.13627287   -3.87218547
 H                  1.25265829    2.04654777   -0.35263390
 C                  4.83110135   -2.43149716    0.69101426
 C                  3.55602310   -1.92955564   -1.39910266
 O                  2.39982893   -2.00826099   -1.75952850
 O                  5.87186763   -2.24148386    1.28352311
 H                  4.09464375    1.59738512    1.77195052
 C                  3.40850956    3.38272699    0.79808879
 C                  3.30966195    4.06390251    2.03849209
 C                  3.12368887    4.08744927   -0.39978597
 C                  2.93687322    5.39933323    2.07944377
 H                  3.52727991    3.52743634    2.95754565
 C                  2.74621355    5.42183471   -0.34871208
 H                  3.21001060    3.59269386   -1.36071557
 C                  2.65132794    6.07721582    0.88671789
 H                  2.86417734    5.91577810    3.03089935
 H                  2.53076952    5.95924023   -1.26639416
 H                  2.35787576    7.12217562    0.91905760
 Au                -0.59098918   -0.00292858    0.16597692
 P                 -2.67956254   -1.10230359    0.30982466
 C                 -4.14585945   -0.09622141   -0.20002006
 C                 -2.66306094   -2.64260526   -0.81324412
 C                 -2.94512216   -1.50934925    2.17005599
 C                 -5.43528479   -0.61892293    0.02712950
 C                 -4.03594361    1.21631228   -0.72214583
 C                 -3.99718819   -3.40371328   -0.91805686
 C                 -1.55739473   -3.59435821   -0.31493466
 C                 -2.29011259   -2.13075782   -2.22197663
 C                 -1.58516961   -1.91737386    2.78623443
 C                 -3.39406291   -0.18955653    2.83491115
 C                 -3.96158821   -2.62315072    2.48048478
 C                 -6.58847923    0.11790851   -0.22742847
 H                 -5.54940227   -1.62026966    0.41824853
 C                 -5.21302397    1.95004236   -0.95936466
 C                 -2.76795319    1.92132291   -1.09147096
 H                 -4.77887085   -2.79032847   -1.37377748
 H                 -3.84789912   -4.27699339   -1.56516287
 H                 -4.35701349   -3.76981299    0.04586164
 H                 -1.41886043   -4.39509999   -1.05172713
 H                 -0.59876508   -3.07709885   -0.19480543
 H                 -1.82001252   -4.06651977    0.63619273
 H                 -3.03844856   -1.43049841   -2.60757527
 H                 -1.31440030   -1.63543435   -2.23212488
 H                 -2.24542189   -2.98367118   -2.91034369
 H                 -1.15174643   -2.79868240    2.30720594
 H                 -0.85272242   -1.10584188    2.73015173
 H                 -1.74211405   -2.15705025    3.84548416
 H                 -3.39373213   -0.32386098    3.92351924
 H                 -2.70735333    0.63243509    2.59961857
 H                 -4.40174681    0.10527082    2.52942490
 H                 -4.04658774   -2.72066920    3.57002777
 H                 -4.96315383   -2.40996256    2.10209914
 H                 -3.63871141   -3.59369561    2.09350818
 C                 -6.47650839    1.41919632   -0.71626792
 H                 -7.56291700   -0.32210287   -0.03750004
 H                 -5.11840658    2.95680053   -1.35584424
 C                 -2.11711638    1.61387919   -2.29287785
 C                 -2.32726359    3.00848284   -0.32228298
 H                 -7.36355517    2.01407936   -0.91384004
 C                 -1.02703781    2.37382562   -2.74058432
 H                 -2.49347147    0.78986865   -2.88518118
 C                 -1.24304912    3.79251081   -0.73678716
 H                 -2.86160418    3.23720515    0.59281708
 C                 -0.61529697    3.45073803   -1.94440053
 H                 -0.56650126    2.20059760   -3.69074122
 H                 -0.91355694    4.65861743   -0.20181592
 H                  0.20535009    4.06807004   -2.29162901

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


