#
#Opt
#
! optts freq wb97x-d3bj def2-tzvp(-f) def2/J tightopt verytightscf
%pal nprocs 8 end
%maxcore 8000
%basis NewGTO Au "def2-TZVP" end
newecp Au "def2-ECP" end end
%geom calc_hess true
trust 0.2 end
%cpcm smd true
smdsolvent "dichloromethane"
end

* xyz 1 1
  C          -0.98822802109485     -1.20216203208919      0.26233566337423
  H          -0.62839476958567     -2.10994929629671     -0.24098127670382
  H          -2.09265271642939     -1.25444429818434      0.23020841296939
  C          -0.52352160300598      0.06505595537072     -0.43735302485562
  C          -0.58971790865732      1.17765974816806      0.31645366515345
  H          -0.30002403727613      2.16491094070318     -0.05757272774161
  C          -1.12218625879047      1.16267815271497      1.73345517041026
  H          -0.92681023665722      2.09548420151071      2.27343569837528
  H          -2.23738073997239      1.08311043650240      1.70350070623626
  C          -0.79653333455178     -0.04479619699357      2.51243317383903
  C          -0.53039845121491     -1.25855205848126      1.71889665425343
  H           0.58104221736362     -1.31511156366286      1.75465468741817
  H          -0.87276193870800     -2.17062109462882      2.22624446095585
  Au          0.11780280475714      0.04856491629068     -2.39583677733564
  P           0.83531722699673      0.03529394375637     -4.62712341260830
  C          -0.28075326617983      0.91265592399565     -5.76895746751513
  C           2.46165025521795      0.81276096743226     -4.89059406463219
  C           1.00340627424736     -1.63103548674431     -5.34404715097632
  H           0.03255917190055     -2.14679188668830     -5.30836690729859
  H           1.34461045836996     -1.57304523076188     -6.38877944004805
  H           1.72903464189234     -2.21339811894858     -4.75755230631925
  H          -1.27905168447525      0.45244257743072     -5.73360070081748
  H           0.10334066187932      0.86775489562618     -6.79934621685981
  H          -0.37044800392104      1.96479181447956     -5.46137910476111
  H           2.42928875668182      1.85897020992941     -4.55288721472246
  H           2.73844591283738      0.78449312588276     -5.95545478871596
  H           3.22447157775128      0.28018419767475     -4.30391118252344
  C          -0.73877614504148     -0.04291541074176      3.94487606816782
  C          -0.64136889702339     -1.25940763234686      4.66895382827277
  C          -0.77301892364152      1.17011264109236      4.67961233504146
  C          -0.58231298186020     -1.26810125743183      6.04892479304908
  H          -0.62709584062040     -2.21626098307401      4.14700958768460
  C          -0.71436114816866      1.17126890021133      6.06021832072176
  H          -0.82598677132934      2.13098206957541      4.16825791924221
  C          -0.61992347432591     -0.04976922605538      6.73598919282246
  H          -0.51480016586277     -2.20829867005972      6.59823856306867
  H          -0.73339589385268      2.10885858667941      6.61773526251189
  Cl         -0.54601374764886     -0.05378376183751      8.45656660086669
*

