#
#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          -2.00212620057926     -1.44221078986837     -0.40443889611470
  H          -1.67838284158726     -2.41122919937063     -0.81356136640529
  H          -2.94593276976800     -1.21986100451601     -0.94343664822826
  C          -1.04642961748468     -0.36385881899412     -0.77837229438850
  C          -0.91208609175630      0.54957826520656      0.29376282276517
  H          -0.08816352672655      1.26207151470704      0.36315545472856
  C          -2.26778901899307      1.04805729187614      0.89728724559040
  H          -2.16059726702550      2.05093829552815      1.31646755605816
  H          -3.16687011088140      0.88382215909591      0.29832560881992
  C          -1.62167876345229     -0.07020326836599      1.56621318850983
  C          -2.12847229442744     -1.43967948924887      1.12576573668121
  H          -1.49688218284060     -2.22957791158492      1.55664979933514
  H          -3.15784780215876     -1.60744060223214      1.47485135100149
  Au         -0.06819799755418     -0.23640584394062     -2.55572774670491
  P           1.05174537863049     -0.07298425056741     -4.61605257992514
  C           0.16662562159939      0.95543274323803     -5.82672304866934
  C           2.71001359306029      0.66038783546717     -4.48215914059862
  C           1.29867210948765     -1.67632074018261     -5.43696459433551
  H           0.32463679548060     -2.15763896586111     -5.60668872576963
  H           1.80938001453720     -1.53779659069060     -6.40178593432897
  H           1.90720930132891     -2.32927780115321     -4.79463986656804
  H          -0.83055787892655      0.53095842631800     -6.01297448254982
  H           0.72749942585794      0.99650597723098     -6.77253994182932
  H           0.04790309682340      1.97381410831329     -5.42914361240283
  H           2.63460559764302      1.66765768885979     -4.04745366879818
  H           3.17965649234678      0.72640633111211     -5.47508340426432
  H           3.33581361815712      0.03902249784075     -3.82525047992542
  C          -0.95842462751214      0.08538712478688      2.89905045515395
  C           0.19089377024573     -0.66141459387580      3.19749556358825
  C          -1.47853462695351      0.94803279851446      3.86642396873009
  C           0.80906404398659     -0.54150716822071      4.43459046563019
  H           0.60988727936973     -1.33741173377540      2.44715175539175
  C          -0.86257234808130      1.07303471285591      5.11148163960759
  H          -2.37974300320764      1.52788659262228      3.65386561260403
  C           0.28017184524897      0.32991751348475      5.39275565756012
  H           1.70723264303880     -1.12370245924044      4.65617089260892
  H          -1.27809796402774      1.75092422598952      5.85918592009557
  C           0.97301667481476      0.44418539165352      6.72472951457466
  F           2.24505256459316      0.84706569027814      6.58455445444037
  F           1.01519619628630     -0.73521433698447      7.36229879149044
  F           0.37286469140734      1.31319120369406      7.54355991684095
*

