#
#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          -1.90778368321752     -1.44269174323361     -0.04250109379085
  H          -1.59923357367937     -2.39687434594869     -0.47332472237898
  H          -2.86967646990260     -1.20671693614967     -0.52123948064194
  C          -0.96701332708589     -0.35942340037888     -0.43623744579036
  C          -0.79470060943601      0.53447178600997      0.63473710143164
  H           0.00832894826915      1.25557151112394      0.68499322668413
  C          -2.15323423980881      1.01635788981202      1.26802438484581
  H          -2.04727186097439      2.01334632824612      1.67631687835806
  H          -3.04843546520500      0.83134162702166      0.68827516268195
  C          -1.47033662085363     -0.08632460125140      1.91795763684735
  C          -1.96542984365844     -1.46117951534492      1.49329896039440
  H          -1.29885618472717     -2.23234268381597      1.88228921285878
  H          -2.96897892058787     -1.64892333302339      1.87940806245302
  Au         -0.05679111657243     -0.22059770717582     -2.24816286939715
  P           0.96927729335604     -0.05093013728595     -4.32142200648455
  C           0.00287398832338      0.90903492121615     -5.51303806577750
  C           2.58881742057738      0.75445161770587     -4.26319347146463
  C           1.26128156245114     -1.64763072972865     -5.12118261881237
  H           0.30980759216130     -2.16374425326387     -5.26196502760188
  H           1.74223531071889     -1.49822959242806     -6.09064908775749
  H           1.90439133598671     -2.25978018068645     -4.48619290908113
  H          -0.96992046184214      0.43555373418000     -5.65787682873059
  H           0.53049233406052      0.95822914848439     -6.46840907135335
  H          -0.14954607010300      1.91913079595643     -5.12843707933189
  H           2.47852378526556      1.76358010431766     -3.86184040972696
  H           3.01757445122576      0.80598813218490     -5.26671302364587
  H           3.25500771622476      0.18622917632791     -3.61145573967633
  C          -0.77925846238245      0.08234125323152      3.22916245925433
  C           0.39615013537150     -0.62614127493373      3.48389043009884
  C          -1.30472589400477      0.91912648806249      4.21029889616968
  C           1.04612973654132     -0.49924685684622      4.69894888219863
  H           0.81050406755697     -1.27476102933669      2.72016201073056
  C          -0.66764081850602      1.05604917863665      5.43542902967725
  H          -2.22218358180537      1.46425417849608      4.02254053060225
  C           0.49819055375390      0.34359344804763      5.65457152710363
  H           1.96082389363678     -1.03827284034722      4.90434671639120
  H          -1.06910489688004      1.70118859863705      6.20500859154243
  N           1.18409278543645      0.48516048274970      6.95153699896311
  O           0.68627679522427      1.22044670947303      7.78358805481440
  O           2.21361316509115     -0.14074627874196      7.12330749734236
*

