#
#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          -0.39008149733210     -1.29752647674986      2.82856659813151
  H           0.22021510137271     -1.78999805114104      2.06942935398696
  H          -0.71668380026215     -2.06457228530895      3.53529033820048
  C          -1.59675240151562     -0.74103755422681      2.20217042016802
  C          -2.65937450765459     -0.25050906348947      1.85650706139512
  H          -3.65981877568050      0.12363092706504      1.75568597336613
  C           0.43140578432333      2.13376876384467      2.77954992189578
  H           0.77448082615993      2.94474634281569      2.14647677921722
  H          -0.28864377298431      2.37934287271616      3.55327511869148
  C           0.88602073827367      0.88857678480044      2.64554373476779
  C           0.40698676691851     -0.20772155575665      3.56468226697174
  H           1.24858676676407     -0.69492845139325      4.06147512531367
  H          -0.21987163687416      0.22922208482926      4.34317144887096
  Au         -1.45261062057588     -0.12193584484222     -0.01377969784297
  P          -0.90638782782423      0.14666791705589     -2.21959710909307
  C          -2.32454701372656     -0.21984660666083     -3.27850348268918
  C          -0.39119235057821      1.81470691767470     -2.67928777151377
  C           0.40327508488548     -0.96967464943577     -2.76560352312511
  H           0.07974865053223     -2.00099126351522     -2.61431074458045
  H           0.60814809420214     -0.80199094941883     -3.82550432999993
  H           1.30811897501461     -0.79151453638026     -2.18477025246889
  H          -2.65768813595573     -1.24364301982788     -3.10110395143285
  H          -2.03790136380933     -0.10417527954227     -4.32641895312535
  H          -3.14083908689793      0.46600329616195     -3.04565658894320
  H          -1.18623809854075      2.51863764857628     -2.42732358404325
  H          -0.19892310625767      1.85076566933354     -3.75412879400623
  H           0.51372850562704      2.09037329344366     -2.13872975362368
  C           1.85994210543697      0.53408002069245      1.57513150549044
  C           2.79509394326213     -0.48798062124936      1.76056847738733
  C           1.85345760873026      1.22181534196676      0.35697676851023
  C           3.71355216015396     -0.80300401942979      0.77234323209385
  H           2.82243882115771     -1.04198561628130      2.69046780581951
  C           2.77070834063075      0.92464714596685     -0.63451509882238
  H           1.11372541787479      1.99282468822175      0.18023203466568
  C           3.70236931766987     -0.09246947397066     -0.42632292532409
  H           4.43778905379467     -1.59392058329501      0.92714159094878
  H           2.76128162737548      1.46382782994389     -1.57418117614424
  C           4.63891072561216     -0.42316188457926     -1.46748454318546
  N           5.37990360069723     -0.68927686861427     -2.30627005592857
*

