#
#Opt
#
! opt 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
%cpcm smd true
smdsolvent "dichloromethane"
end

* xyz 1 1
  C          -0.04354880574586     -1.38938771001129      0.77995603020786
  H           1.04687778828454     -1.43411304895696      0.95091134727351
  H          -0.28596393468434     -2.27948809293509      0.18047995968508
  C          -0.40178439478784     -0.12042301386981      0.04069265712106
  C          -0.92873967270837      0.89331757348516      0.75062035971675
  H          -1.22261771096074      1.83687374116021      0.27804814034863
  C          -1.10631247485846      0.89935850663882      2.25977760296728
  H          -0.66203509245796      1.80387957038376      2.69523489931675
  H          -2.18910472684758      0.96187713334059      2.50448102261428
  C          -0.65107201818348     -0.33000738535711      2.94182289462961
  C          -0.79824491814517     -1.54513990818086      2.12289389469096
  H          -0.51852814551658     -2.46882863856602      2.63695530590055
  H          -1.87593567164143     -1.60147715400444      1.87871295121378
  Au         -0.04212702540341      0.00906128778065     -1.98946244119518
  P           0.35732054996320      0.15604382194470     -4.29399277723996
  C          -0.25507074189849      1.69296490087122     -5.05616747737372
  C           2.12009839396653      0.09185849809190     -4.74957203926094
  C          -0.41632083487306     -1.17715765820935     -5.26507643452127
  H          -1.50591621405229     -1.15546041419502     -5.11635628176045
  H          -0.19413371238070     -1.05781569596156     -6.33637716447125
  H          -0.03673463282369     -2.15069889235743     -4.92166259013010
  H          -1.34127046424760      1.77403570692632     -4.90343606437452
  H          -0.03850515313516      1.70482603013746     -6.13515411099315
  H           0.22932836208921      2.55804505766265     -4.57997530314163
  H           2.65398595670339      0.92443789547492     -4.26846941859192
  H           2.24308718856250      0.16349618071112     -5.84086388201782
  H           2.55689000343447     -0.85345097580656     -4.39560148278851
  C          -0.13442999858330     -0.32995027688845      4.27237207759428
  C           0.37473136213639     -1.51966768307369      4.85390252491381
  C          -0.12870467470836      0.86148514778633      5.04954899942819
  C           0.86957707085879     -1.50292942705116      6.14664701116106
  H           0.39645214223462     -2.45205418041392      4.29055588839990
  C           0.34768406446424      0.88151453855211      6.35204092132085
  H          -0.52094607112161      1.78788154287671      4.62767385139881
  C           0.85184974021251     -0.31919887755939      6.88467178110874
  H           1.27202105435315     -2.41624218344982      6.58915743363000
  H           1.24126061434611     -0.32202015164621      7.90728614612963
  C           0.34257813128687      2.13794421444444      7.17822488127995
  H          -0.21467108087818      1.98809742257868      8.11531731530054
  H           1.36852578082599      2.42884341765317      7.45157302092081
  H          -0.11795799307887      2.97385468999320      6.63447605958776
*

