#
#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          -2.86939498032459     -0.95230265472348      1.45719193622606
  H          -2.18158037880502     -1.79846989456127      1.47746832557701
  H          -3.84183348282249     -1.31436310265411      1.80172557060874
  C          -3.03589597455087     -0.53443260979940      0.06139869861244
  C          -3.29219050563759     -0.18898861833315     -1.07952554268791
  H          -3.72952798637107      0.07979747140637     -2.02117040968489
  C          -1.16684105913951      1.93902685891508      1.16880575334449
  H          -0.28717413681786      2.42845512249010      0.76838105708803
  H          -2.12579139662401      2.38537502210282      0.92761129590543
  C          -1.10399183181529      0.84315956485767      1.93251013684779
  C          -2.39384804084926      0.19210806645082      2.37760463346423
  H          -2.29656152621560     -0.21868972550365      3.38418551494744
  H          -3.17654097033391      0.95132107900684      2.40503676914591
  Au         -1.04297629817648     -0.10464203583060     -1.04322462831883
  P           1.13730480174586     -0.01870482043850     -1.72508257832451
  C           1.32949105770434     -0.34170604315042     -3.49303461912510
  C           1.93985880926348      1.57393201458262     -1.43962119289464
  C           2.15957061034026     -1.24855201029699     -0.88674598999989
  H           1.78978932826655     -2.24720817174741     -1.12577883634426
  H           3.19707622742666     -1.15341341838286     -1.21587426423282
  H           2.10106089949708     -1.09620934712243      0.19124964106586
  H           0.92127197594450     -1.32561772289512     -3.72965670316002
  H           2.38844671831374     -0.31007354244258     -3.76014553604546
  H           0.78686761586784      0.41473736404849     -4.06258579012566
  H           1.39045259495734      2.35709459741535     -1.96483373952409
  H           2.96754710189824      1.53723108271431     -1.80849910086975
  H           1.94416468886216      1.79484115821532     -0.37257236613107
  C           0.19572674983235      0.20830113036432      2.29708184962918
  C           0.25629648619762     -1.10524176785330      2.76598501207130
  C           1.39674295477177      0.91538166143129      2.16918247695816
  C           1.48107143253822     -1.69229884793247      3.06630498067331
  H          -0.64607252476835     -1.68446534006935      2.91051340380723
  C           2.62857613620256      0.33693431094905      2.44872417214749
  H           1.37762389463441      1.95222527588739      1.85437338661988
  C           2.66106575087012     -0.98275615293990      2.90262571589583
  H           1.50930411578324     -2.71416032726606      3.42986754380889
  H           3.61401217647589     -1.44949614007385      3.13219133613622
  C           3.90367110663998      1.10284173724590      2.21154230519870
  H           4.29480063705208      0.87857376753223      1.21318240213685
  H           3.73535013242278      2.18021111236908      2.26880019210998
  H           4.67287455974278      0.82957558603183      2.93707630744240
*

