#
#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          -2.39558505063428     -0.72995786146806     -1.43689295626771
  H          -2.39938179880859     -1.72873099683713     -1.87683948089167
  H          -3.20305649757327     -0.18590529209304     -1.94925852209872
  C          -1.13573588016410     -0.01332225487424     -1.76885489250593
  C          -0.72758773727479      0.76611975636853     -0.66922332625669
  H           0.26662356574863      1.17702006350512     -0.56886400811273
  C          -1.87435717155578      1.66601927013883     -0.07939748838715
  H          -1.46431202754584      2.56683952691740      0.35926980417887
  H          -2.75671677064027      1.79369333321943     -0.69293011887626
  C          -1.62387269067398      0.38976909126030      0.56650775038875
  C          -2.52695121203812     -0.74059213036580      0.09456636378020
  H          -2.17094879260380     -1.69219456908446      0.49264315508341
  H          -3.55231983475026     -0.58844715200984      0.43587702826617
  Au         -0.13835161170544     -0.18469425127470     -3.53024834822005
  P           1.00290811199093     -0.39353313182213     -5.53927502858203
  C           0.22186937981458      0.50720980206430     -6.90057245887159
  C           2.70360078842204      0.22038302238276     -5.47401427484415
  C           1.13543353611199     -2.10416551017136     -6.11436852258996
  H           0.13548751898105     -2.51967625640911     -6.25223664624155
  H           1.67890726762441     -2.13929344640461     -7.06141347114871
  H           1.66526656144996     -2.69928589331661     -5.36830766909071
  H          -0.79319703995820      0.13419314780560     -7.04875188899644
  H           0.79860220284046      0.36963780956469     -7.81816466821658
  H           0.17571524318171      1.56976046580279     -6.65512958538579
  H           2.69836005736419      1.27781932193811     -5.20336567661463
  H           3.18465253831889      0.09531650112854     -6.44689943082546
  H           3.26166856836485     -0.33479923454936     -4.71778091474990
  C          -0.97212210212542      0.30755754677302      1.90489372139795
  C          -1.23992699053588      1.24535567649066      2.89118386972932
  C          -0.09536904212827     -0.73651490921267      2.17860772693875
  C          -0.63833913996410      1.15501890437338      4.14040640066421
  H          -1.93173946478754      2.05363482705503      2.69268336255383
  C           0.51472132117838     -0.84690048416463      3.41747559034538
  H           0.12524460044705     -1.46626060120240      1.40960636763923
  C           0.23527073668220      0.10682792019756      4.39023999473453
  C          -0.96114486194596      2.21038489245700      5.18000294232886
  C           1.46506279383391     -2.00291778236715      3.66025530011896
  N           0.88327020401850      0.00049068097561      5.71750639743695
  F          -2.13028696355514      2.81414183690553      4.91382426018288
  F          -0.02284555805083      3.17247392974853      5.22446112517280
  F          -1.06114647082838      1.68884236195054      6.41712263420251
  F           1.94487196133123     -2.49005579245947      2.50462058406133
  F           0.86005988327984     -3.02225567072203      4.29509893495512
  F           2.52664782822144     -1.63908078781425      4.40365037248126
  O           1.68648505963430      0.85977005890967      6.00753732462736
  O           0.56134430100772     -0.93838407930989      6.41223117650577
*

