#
#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
  Au         -0.01130922186647     -1.75244301120140      0.20801903882484
  C           1.27869022801743      0.56255041749942      0.83510056563856
  C           0.13981890962296      0.12235980240950      1.16219144339821
  C           0.57285336941008      2.70536487677355      1.88465569410661
  C           1.89126922542864      2.38829132624983      1.91204230981995
  H           2.29224361557703      1.79758030604153      2.72749521696421
  C          -0.93725659579215      0.74123205618213      1.97218910208562
  H          -1.39093207776315      0.02796217111924      2.66086120528828
  H          -1.72062694533282      1.07958087896554      1.28856552327181
  C          -0.35349681825534      1.94982807796947      2.76951438915820
  P          -0.29419543357936     -3.80306457833091     -0.77481653183586
  C           0.26536339447949     -3.86307285664578     -2.49368037011784
  C           0.59650247792828     -5.13361612473102      0.06592799540358
  H           2.18879061925616      0.53575939694827      0.26394736273776
  C          -2.02192292684214     -4.33593416657771     -0.81567501182625
  H          -2.61423080309987     -3.60861617583007     -1.37373117346742
  H          -2.09812435677588     -5.31422677445531     -1.29592624615587
  H          -2.40744715778034     -4.39892178491937      0.20351262659858
  H          -0.28860207846602     -3.12966042691535     -3.08232801251039
  H           0.09926571793170     -4.86177536807986     -2.90437982405569
  H           1.32900391159355     -3.62246795661689     -2.53871802127625
  H           1.66595123982989     -4.91565330403159      0.06018724525197
  H           0.41455660914303     -6.08325930812177     -0.44274545926394
  H           0.25513094300410     -5.20265475173639      1.10034398081930
  H           2.60404936084211      2.87111292340170      1.25300178586526
  H          -1.19016681227088      2.55529261537991      3.11740698329573
  H           0.18988561084032      1.56759356559514      3.63366777861707
  C           0.01050887490357      3.62813126814925      0.86680965810681
  C          -1.10590008666169      4.41415357455253      1.15554886343399
  C           0.58464301398334      3.73082756419443     -0.40224745754175
  C          -1.62760853087091      5.29412529761404      0.21081588277554
  H          -1.56780105915948      4.36119993503738      2.13410331289813
  C           0.05759745951236      4.59887599945203     -1.34907021484581
  H           1.43747256396515      3.11600023290472     -0.67111167876168
  C          -1.05182175397549      5.38876767623506     -1.04383939840726
  H          -2.48844936106721      5.90249562784874      0.46400722199624
  H          -1.45023155885859      6.06221078158208     -1.79405016192150
  C           0.69230856851348      4.65995897306490     -2.68797552927113
  O           0.31969517185274      5.38011441295128     -3.58765567161776
  H           1.55832579278232      3.98571863007173     -2.82544833347985
*

