#
#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          -2.85476970023727     -0.96940603621707     -0.40725319016534
  H          -2.08687197159685     -1.64316918027944     -0.02596153564094
  H          -3.50965623215731     -1.55851266384121     -1.05334554231483
  C          -2.21001921068818      0.06121446720645     -1.23280920098365
  C          -1.80965684286095      0.99249369208925     -1.91106832844664
  H          -1.66604266215740      1.83292597888077     -2.56180008227062
  C          -3.53889514129960      1.94979727640899      1.63551029565745
  H          -3.06097281800810      2.75682174774998      2.18079519454492
  H          -4.53445680968235      2.13523382405549      1.24499843172391
  C          -2.94714227961874      0.76818645665177      1.46531649907224
  C          -3.66652766752595     -0.34865277515372      0.74536280682750
  H          -3.91091014040080     -1.15663228941445      1.44057312988512
  H          -4.60815605686276      0.03993342875556      0.35512744886369
  Au          0.09464637750629      0.10365285147602     -1.12469384438679
  P           2.30059844633537     -0.44812291084221     -0.89682682682266
  C           3.00629824960687     -0.91543230903629     -2.49412674439066
  C           3.34050501007141      0.89315263207115     -0.28371665728449
  C           2.60471594207374     -1.85832976526649      0.18942663536996
  H           2.00242839639985     -2.70771745264449     -0.13658309331948
  H           3.66417076530978     -2.12194880423173      0.14418698997456
  H           2.33970923015075     -1.59962365275637      1.21391046647013
  H           2.46847973333084     -1.77838539127961     -2.89060686323873
  H           4.06204339532817     -1.16791032487720     -2.37009273044881
  H           2.90950278579692     -0.08388370523615     -3.19412934968667
  H           3.26754533560588      1.74527563542902     -0.96194916788804
  H           4.37826394951605      0.55555197835369     -0.23130305968138
  H           3.00279311642475      1.19950247355654      0.70644118929260
  C          -1.56573392806518      0.51023671542478      1.95497399859732
  C          -1.17980355314442     -0.74865483593271      2.41055840691872
  C          -0.61896961070821      1.54066676736092      1.96306367032161
  C           0.10561306694391     -0.97034486416260      2.89308341418467
  H          -1.88837057363363     -1.56853887506916      2.41345811377078
  C           0.65653023620478      1.32440220570865      2.44982896958433
  H          -0.87616144783656      2.52190512735941      1.57707042454743
  C           1.02766925322116      0.06190493322371      2.92156528696136
  H           0.40115706555143     -1.94802528131552      3.25771223743892
  O           1.63054415348609      2.28705862365867      2.49308218590880
  H           1.27050438154834      3.12965195082308      2.18328066352972
  O           2.28867951776105     -0.16846055723544      3.38693588767128
  H           2.78154584831078      0.66477415854794      3.37659492985273
*

