#
#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          -0.85618405651965     -1.25118849748589      2.79806117831994
  H          -0.17114686837251     -1.69922966473121      2.07650728379371
  H          -1.28390845479337     -2.06351535717141      3.39071153311764
  C          -1.95775858918272     -0.59912636860410      2.07681343282515
  C          -2.93412237167687     -0.02101990463117      1.62771831183704
  H          -3.87753832142380      0.45012542263017      1.43086934754968
  C          -0.04832664553946      2.17548273839757      3.32619231830771
  H           0.32205482668279      3.07674048317796      2.84976112029255
  H          -0.78452143512850      2.29888965226166      4.11398617390293
  C           0.38941452219639      0.96290076521032      2.98677440666126
  C          -0.12497482166979     -0.25626810287990      3.71461192309402
  H           0.69654919314290     -0.79610690156428      4.19196615626363
  H          -0.80429862675140      0.06554573874099      4.50518787352176
  Au         -1.56149912150218     -0.11170602186884     -0.13335347981248
  P          -0.71246520900898     -0.03985554831675     -2.25460203000731
  C          -1.87109122566699     -0.71216557856169     -3.46682750788515
  C          -0.31764947283866      1.62416148140248     -2.83135447448455
  C           0.79791646522945     -1.01406679551404     -2.42026434775904
  H           0.57907022296198     -2.05891703349186     -2.19339710516392
  H           1.18208097920193     -0.93107969568382     -3.43957558368849
  H           1.54065497944004     -0.64373564530757     -1.71518305274394
  H          -2.10480715300017     -1.74682958078972     -3.21058248844557
  H          -1.42370455689752     -0.67377242723182     -4.46287634015417
  H          -2.79149075359477     -0.12590391859085     -3.45715979812657
  H          -1.22365961413153      2.23262357795913     -2.82441057144013
  H           0.08192658274869      1.57458120642560     -3.84695560815374
  H           0.42047260023288      2.07588869163497     -2.16873991479598
  C           1.37762853301968      0.76661621880663      1.88979779894602
  C           2.26316148284757     -0.31431325702263      1.89337907938354
  C           1.46118541893936      1.66758718418795      0.82524510170996
  C           3.21243572104564     -0.47217229658918      0.89325709871741
  H           2.22862456926364     -1.04205437187611      2.69612658716683
  C           2.42050726097777      1.51740134030212     -0.16504327548949
  H           0.76331155767124      2.49538330267376      0.76560656485420
  C           3.31468685491555      0.44653126172881     -0.15179420425563
  H           3.88014909361221     -1.32631570371200      0.93628196874003
  H           2.46729001033746      2.23602915117930     -0.97723910828743
  C           4.29278892728567      0.29471551768722     -1.26335404969024
  C           5.61765696860665     -0.39393801242900     -1.05684966418627
  C           4.55152828227180     -1.06733090785859     -1.86392576715955
  H           4.29356112603984      1.12478962942831     -1.96056051412570
  H           5.82781724250526     -0.78213382886021     -0.06708058848769
  H           6.47386889442020      0.01430429426212     -1.58044301702855
  H           4.67847664110182     -1.12517113673955     -2.93850669891133
  H           4.03042623100036     -1.90503622058492     -1.41429465872210
*

