%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                  1.26079951    0.30477369    0.01475173
 C                  2.25559477   -0.58205428    0.18687845
 C                  4.42931545   -1.72961198   -0.11486341
 H                  5.01324925   -1.78851602    0.80748390
 H                  5.10480788   -1.93913075   -0.94591770
 C                  3.74817098   -0.34646346   -0.26253754
 H                  3.78496914    0.02361873   -1.28713192
 C                  4.12317150    0.64804901    0.73892483
 C                  2.17975116   -1.98576322    0.74711551
 H                  1.18622058   -2.41753149    0.61763074
 H                  2.42042872   -1.98860211    1.81865744
 C                  3.27719908   -2.76023808   -0.01538939
 O                  2.79767214   -4.99326763    0.58091213
 O                  3.74467683   -3.79161152   -2.08976830
 C                  3.05864130   -6.22663550    1.28638735
 H                  3.07620378   -6.04730245    2.36408844
 H                  2.23918263   -6.89246013    1.01906363
 H                  4.01690107   -6.64534237    0.96973098
 C                  3.39531642   -4.24274200   -3.41620652
 H                  2.56673183   -4.95334461   -3.36513305
 H                  3.10915535   -3.39316205   -4.04104585
 H                  4.29201293   -4.72326627   -3.80542503
 H                  1.56457251    1.29742915   -0.33260771
 C                  3.69824701   -4.01395801    0.75262643
 C                  2.77467482   -3.16300606   -1.40812341
 O                  1.66713034   -2.93927862   -1.85052201
 O                  4.67750087   -4.10203046    1.46315127
 H                  4.29878730    0.25715936    1.74044803
 C                  4.18214477    2.03675498    0.58418375
 C                  4.42954392    2.84798722    1.73366043
 C                  3.99461727    2.69489468   -0.67438128
 C                  4.48799796    4.22044498    1.65177638
 H                  4.57302835    2.36503892    2.69579936
 C                  4.04458280    4.06162936   -0.76382881
 H                  3.81267244    2.11279989   -1.57035430
 C                  4.29040731    4.84448426    0.39541650
 H                  4.67842765    4.80781293    2.54077030
 H                  3.90454139    4.57619246   -1.70791657
 O                  4.31928744    6.15740022    0.19570307
 C                  4.56751810    7.05150946    1.29766675
 H                  4.53818562    8.05116188    0.86684950
 H                  3.78813554    6.94903463    2.05871090
 H                  5.55335170    6.85993809    1.73176854
 Au                -0.79723038   -0.09050458    0.26045082
 P                 -3.11253579   -0.51357052    0.48811803
 C                 -4.23137704    0.75980662   -0.25274263
 C                 -3.54017001   -2.16765769   -0.35758263
 C                 -3.47829504   -0.49740791    2.37561046
 C                 -5.61579512    0.66999192   -0.00224025
 C                 -3.75222302    1.87570719   -0.98255002
 C                 -5.03649289   -2.52781753   -0.39591534
 C                 -2.75140374   -3.29011790    0.34567738
 C                 -3.04030672   -2.03628533   -1.81308376
 C                 -2.29008243   -1.15802456    3.11545323
 C                 -3.52934531    0.99046675    2.78677449
 C                 -4.76991686   -1.20724230    2.82054993
 C                 -6.51088502    1.64572686   -0.43158062
 H                 -6.01036505   -0.17407068    0.54599790
 C                 -4.67104096    2.85828311   -1.39542885
 C                 -2.33661164    2.11868793   -1.40474139
 H                 -5.61142363   -1.80846195   -0.98492483
 H                 -5.14487826   -3.50687848   -0.87897208
 H                 -5.48332848   -2.60317695    0.59771488
 H                 -2.84960151   -4.21339923   -0.23840401
 H                 -1.68457814   -3.05144273    0.42233483
 H                 -3.13544797   -3.49517657    1.34917572
 H                 -3.55825339   -1.23211675   -2.34609445
 H                 -1.96373951   -1.84590021   -1.86019381
 H                 -3.24321403   -2.97385582   -2.34515317
 H                 -2.12803032   -2.19538283    2.81270648
 H                 -1.35634651   -0.60878335    2.95835571
 H                 -2.50610098   -1.15465552    4.19128359
 H                 -3.56444777    1.05402815    3.88123012
 H                 -2.63693757    1.53113485    2.44929959
 H                 -4.41150788    1.49930053    2.38859206
 H                 -4.87626783   -1.08475569    3.90568826
 H                 -5.66975676   -0.78989569    2.36462390
 H                 -4.73905735   -2.28151723    2.61821656
 C                 -6.03288591    2.75625950   -1.12662419
 H                 -7.56992523    1.53859752   -0.21671110
 H                 -4.29362461    3.71201147   -1.95078038
 C                 -1.80412948    1.43507515   -2.50502545
 C                 -1.60139364    3.15451318   -0.80951481
 H                 -6.71336575    3.53300867   -1.46334432
 C                 -0.54351129    1.76633776   -3.02207265
 H                 -2.40197992    0.66028432   -2.96733897
 C                 -0.33941895    3.51595243   -1.29820303
 H                 -2.04553256    3.68095357    0.02764885
 C                  0.16111052    2.80537865   -2.39991381
 H                 -0.15432548    1.30692792   -3.90659343
 H                  0.22540332    4.33364326   -0.90164597
 H                  1.12304583    3.09564196   -2.80679915

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
41 F
42 F
43 F

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

Au 0
SDD



