#
#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          0.04996608158687     -2.34223454154919      0.17187212556701
  C           1.50180728040611     -0.24853789333895      1.05670747874164
  C           0.27007252734030     -0.49216640697189      1.16759097262667
  C           0.91799104742614      2.03175063825241      1.96980867872647
  C           2.15192982683307      1.54437486482875      2.24902429174150
  H           2.30442839163517      0.91245163477544      3.11635371720958
  C          -0.83984439633918      0.29076420026137      1.76223613505633
  H          -1.51348835416525     -0.33843268255528      2.34470510483871
  H          -1.42165989334508      0.72486066286451      0.94460708835659
  C          -0.24717727182388      1.41580967037498      2.66524742423245
  P          -0.33206447946136     -4.34108698990878     -0.87973787358731
  C           0.22391947089934     -4.36813324505635     -2.60048900467286
  C           0.48986852362746     -5.74384613582216     -0.08782316722101
  H           2.49661972884301     -0.41097665211549      0.68489521156736
  C          -2.08493158082778     -4.78269500754776     -0.93645133062440
  H          -2.63840574406398     -4.00784609411180     -1.46985296067008
  H          -2.21099425106018     -5.73942725206664     -1.44862283960057
  H          -2.47387516393714     -4.85929868649986      0.08048235279215
  H          -0.29412939367861     -3.58869265150301     -3.16206573004953
  H           0.00970046344145     -5.34270301613522     -3.04548286095855
  H           1.29790174167020     -4.17761286312007     -2.63907834972238
  H           1.56881399847179     -5.57905346359247     -0.08523327796841
  H           0.26226269187005     -6.66391708909451     -0.63132857921517
  H           0.14311233634418     -5.83373252151916      0.94317896228114
  H           3.03760162311798      1.91312635504695      1.74422471775033
  H          -1.04271516039499      2.13182148303648      2.87036775531106
  H           0.07574747754596      0.97259520983275      3.60746267720688
  C           0.67638579520185      2.98838197562954      0.86496834287171
  C           1.51370719313117      3.03317729545443     -0.24052996059872
  C          -0.42095065354797      3.86482151039516      0.91450962709901
  C           1.27826604655653      3.93275035161193     -1.27823789959839
  H           2.34863509460898      2.34786879243061     -0.32413451436923
  C          -0.65858390469926      4.77022765159234     -0.10332438691355
  H          -1.07794424056237      3.85146575839930      1.77200281597967
  C           0.20393009557573      4.80765038495110     -1.22288367664072
  H           1.94065389934223      3.93652102326137     -2.13362398340525
  O          -0.10394482077760      5.71728310415649     -2.17620752823437
  O          -1.68558276225745      5.65752309886411     -0.12168261809644
  C           0.74882999561235      5.78123659577334     -3.31767099270333
  H           0.33891558003137      6.56678144531550     -3.95104045688016
  H           1.77205158187315      6.04113060711567     -3.03086326663057
  H           0.74634867269417      4.83382612432642     -3.86462439445064
  C          -2.57694712251269      5.64617949054803      0.98970810440696
  H          -3.07738916678519      4.67753670614113      1.08542930845548
  H          -2.05229642801881      5.88462421025267      1.92003704958828
  H          -3.31833436742780      6.41756699701574      0.78491730040462
*

