#
#Single point
#
! wb97x-d3bj def2-TZVPPD def2/J defgrid3 verytightscf
%pal nprocs 8 end
%maxcore 4000
%cpcm smd true
smdsolvent "dichloromethane"
end

* xyz 1 1
  C           0.45124111701599     -2.05559402701391     -0.15534106388312
  H           1.44129163618998     -1.63432431716310      0.04404704855049
  H           0.57596491848463     -2.81320540062150     -0.93171902448506
  C          -0.47235033167444     -0.95925000446485     -0.59155894369325
  C          -1.46989207735178     -0.56170625149052      0.19671146843850
  H          -2.10501886645302      0.28702076947040     -0.03648389446357
  C          -1.85614360876364     -1.23460929399560      1.55450048881433
  H          -2.31185280184835     -0.48822908751050      2.19728905508722
  H          -2.56107266560916     -2.04522821450630      1.36299640869963
  C          -0.57130364065254     -1.74705573165607      2.01890473995037
  C          -0.03205957990032     -2.79452016143966      1.15253167475672
  H           0.79018678318390     -3.35883760378118      1.58276896827341
  H          -0.83954241215769     -3.46848857325184      0.86487987438419
  Au         -0.12545420833604     -0.07117516961155     -2.42576462581512
  P           0.25900309506438      0.91017751492666     -4.47824218895562
  C          -1.22617952465702      1.09733916127791     -5.49982931772981
  C           0.95737424523398      2.57981053574054     -4.38261520955094
  C           1.41820487517477     -0.00937928188980     -5.52488271908340
  H           1.02753575698636     -1.01274359121825     -5.70523878748284
  H           1.55665831743452      0.50390746466995     -6.47940999993125
  H           2.37972684337938     -0.09409017881618     -5.01480860908112
  H          -1.66940403851748      0.11615349243430     -5.68071729654537
  H          -0.97281672705091      1.56392311419713     -6.45476923309510
  H          -1.95341454828803      1.71853782083875     -4.97341739810637
  H           0.27189642370366      3.22906291674889     -3.83447651648583
  H           1.11548275122533      2.98247106249269     -5.38597398947238
  H           1.90977776276236      2.54642424002482     -3.84998023510486
  C           0.18880836523285     -1.13995449709953      3.07330246284772
  C           1.55618916814590     -1.43842350139783      3.22743081653660
  C          -0.41478385501510     -0.22803397453991      3.96216594640889
  C           2.30295374084580     -0.82932991153711      4.21879251225306
  H           2.04125884417063     -2.13470913091686      2.55686950912052
  C           0.33634785767483      0.35523010607044      4.95849959136398
  H          -1.46757820422862      0.00131470757492      3.88585832018258
  C           1.69491519416046      0.06422787310703      5.08902759557208
  H           3.35742996635873     -1.05308106390815      4.32160054567380
  H           2.27433024706840      0.53357329909296      5.87691286806016
  C          -0.28855974273823      1.31625277205773      5.93712711694227
  F           0.33910231079717      2.51097336837543      5.92645526248915
  F          -0.21373580691798      0.85431435331790      7.20333036588753
  F          -1.58615645013368      1.54855177541178      5.67765347267194
*

