#
#Opt
#
! opt freq wb97x-d3bj def2-tzvp(-f) def2/J tightopt verytightscf
%pal nprocs 8 end
%maxcore 8000
%basis NewGTO Au "def2-TZVP" end
newecp Au "def2-ECP" end end
%cpcm smd true
smdsolvent "dichloromethane"
end

* xyz 1 1
  C           2.01189570552011      1.19010442940320      0.26570217675971
  H           1.88541769701021      2.13322493805704     -0.28515572303378
  H           2.99443018399145      0.79841584776564     -0.07047540760164
  C           1.00451839334664      0.17004097216735     -0.14494670753340
  C           0.66651246605235     -0.64445272229574      0.95445059542984
  H          -0.21713949213353     -1.28532452730586      0.96237785856709
  C           1.85427817006308     -1.14638594983915      1.83871518506583
  H           1.59812017428173     -2.08487255928406      2.33524677042633
  H           2.84702235539447     -1.11165341186029      1.38258018695691
  C           1.21267193737638      0.07810017472751      2.27850813488087
  C           1.89269417996625      1.35167363317895      1.78687915822647
  H           1.26558211658958      2.22309138037783      2.02300227358224
  H           2.86254586066852      1.49268674151168      2.28683583039196
  Au          0.19144027694355      0.01663620352740     -2.00382535459800
  P          -0.74714452751850     -0.17401839577476     -4.14993112420454
  C           0.00686639128093     -1.49339639057848     -5.14895516989454
  C          -2.52648413643930     -0.54852085171257     -4.12477624444456
  C          -0.58886047664800      1.33529745848061     -5.15138668106926
  H           0.47516150140595      1.58123118907068     -5.28077651918019
  H          -1.05094618510776      1.19059733514734     -6.13956766407841
  H          -1.08370460787929      2.17275896009263     -4.63848415109927
  H           1.08105446651046     -1.29439083310229     -5.27414181212040
  H          -0.47163721139825     -1.54202770930462     -6.13864798538874
  H          -0.11502898399205     -2.45967778463639     -4.63843693502973
  H          -2.69571973431962     -1.49914287493239     -3.59869175316202
  H          -2.91562487123113     -0.62590846840565     -5.15112362196632
  H          -3.06358680051765      0.24973796052895     -3.59225850968967
  C           0.32486147511734      0.11659885304528      3.47948094001512
  C          -0.79758800203707      0.94915614072169      3.50164073828162
  C           0.61843433441625     -0.66215880867023      4.60965030398037
  C          -1.61959062956951      1.00334121456529      4.62692544228678
  H          -1.04486105050969      1.55518377421628      2.62566706851446
  C          -0.19655754012345     -0.60728532919924      5.73313183263497
  H           1.49930902401015     -1.31081071906002      4.62333964013038
  C          -1.32868916776227      0.23051520934355      5.74765948109239
  H          -2.50404552643870      1.64445387382214      4.64944106089990
  O           0.00737945657868     -1.31731880127037      6.86896963430027
  O          -2.11857183076523      0.28182672266968      6.83614495144271
  H           0.80672372914602     -1.85738203290570      6.80075395867365
  H          -1.76168536127911     -0.31963403228290      7.50695958155463
*

