#
#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           2.00791321668095      1.19658358610948      0.24844552208676
  H           1.86607298154181      2.12112400788734     -0.31205689046563
  H           2.98942190271385      0.80798474485302     -0.06186387901538
  C           1.00551466387723      0.16384450784517     -0.14242260673188
  C           0.68252748038600     -0.63734234853892      0.95592787389274
  H          -0.17594975338099     -1.29299441423190      0.98135086322607
  C           1.89233283565170     -1.10227270440293      1.84336855701629
  H           1.65792207608995     -2.03520310448127      2.33988991614077
  H           2.86804556659908     -1.04431002423751      1.37710222156122
  C           1.22690845689738      0.10583043266748      2.27434813085284
  C           1.87581807733740      1.38491829950212      1.76698417187299
  H           1.22969064919747      2.23760749028792      1.97918307088060
  H           2.83434326698450      1.55124483948585      2.26317777003811
  Au          0.18212188400730      0.00359978448610     -1.99663389197057
  P          -0.74849428824089     -0.18413105957498     -4.11181993394680
  C          -0.01218485434895     -1.50904969881780     -5.10124433852965
  C          -2.52318359447697     -0.53872147475169     -4.08912835142872
  C          -0.57670106591296      1.31050059505163     -5.11774487247783
  H           0.48206907183469      1.54677849910792     -5.23932239299448
  H          -1.03100084703598      1.15732929274745     -6.09942355672923
  H          -1.06848799470607      2.14536079984426     -4.61502371417047
  H           1.05617888053606     -1.32122367840632     -5.22292373488905
  H          -0.48909166071025     -1.55200551735278     -6.08319535135151
  H          -0.14667626467438     -2.46344137480173     -4.58884156352830
  H          -2.69940131304555     -1.47701820623812     -3.55991596197597
  H          -2.90272682977223     -0.61907107845257     -5.11040703820633
  H          -3.04777426159676      0.26411714683081     -3.56779738350622
  C           0.33753145953511      0.13314257219591      3.46844665518748
  C          -0.76025758786372      0.98867292687744      3.50380049557766
  C           0.59985269722344     -0.68229079690768      4.57010480245179
  C          -1.58941325151731      1.02810043114966      4.61690192762052
  H          -0.98057112144628      1.62157412417373      2.65105257762436
  C          -0.22382335458637     -0.64148773274939      5.68238090545491
  H           1.45739090329532     -1.34788264940261      4.57105189136794
  C          -1.32758666492202      0.21631493813088      5.71049628002569
  H          -2.45028991819590      1.68680582832970      4.64861537389647
  O          -0.03330033975030     -1.40456788109630      6.80251696121037
  O          -2.14603096150616      0.26570005199105      6.79632045946031
  H           0.76188450320050     -1.94509899841986      6.69964299295053
  H          -1.82114088589971     -0.35871134669059      7.46113748152162
*

