#
#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
%scf guess moread
moinp "preG2.gbw" end
%geom inhess read
inhessname "preG2.hess"
trust 0.2 end
%cpcm smd true
smdsolvent "dichloromethane"
end

* xyz 1 1
C    -1.113786229584     -1.357647586138      0.485697814040
H    -0.117418878991     -1.672593029028      0.811148803888
H    -1.493063657626     -2.138741681183     -0.176619950462
C    -1.019969689352     -0.036468204882     -0.222252558543
C    -1.502212978771      1.064980676299      0.352123875772
H    -1.411692199879      2.047917369120     -0.100215572165
C    -2.220501232993      1.108481423764      1.730370820469
H    -1.993682034988      2.050396196427      2.220537952503
H    -3.299667924948      1.035576758752      1.569564714199
C    -1.738858013673     -0.079190145036      2.443222418499
C    -2.063258902102     -1.321502675875      1.739177880924
H    -1.939118913432     -2.224591746790      2.329123164532
H    -3.086542851237     -1.259360978304      1.366172135910
Au   -0.125912181011      0.017683346514     -2.074892540534
P     0.907007218406      0.056261408445     -4.147696833989
C    -0.207773257550      0.506483354785     -5.504616603139
C     2.279972103540      1.232472147161     -4.282298609067
C     1.618777144108     -1.531834647054     -4.655718314506
H     0.833240077699     -2.289764455398     -4.684447231847
H     2.075507120330     -1.443805214425     -5.644396946619
H     2.376140047743     -1.839533461885     -3.931796160072
H    -1.028339831995     -0.212185348617     -5.554790177744
H     0.332394895402      0.508742477533     -6.454397901032
H    -0.622695929527      1.499544403398     -5.320236846251
H     1.915474425236      2.241291728147     -4.078018985439
H     2.711281349701      1.198108145779     -5.285608446881
H     3.048062266701      0.982225397430     -3.547694214186
C    -0.877796989949     -0.027330462932      3.577234168614
C    -0.224510291062     -1.194187144278      4.035419610122
C    -0.645986594046      1.186986104435      4.260654790930
C     0.634085880561     -1.148347578444      5.110440938830
H    -0.374114243569     -2.141196868067      3.535583554206
C     0.196969922866      1.237083380233      5.348627826031
H    -1.143705500169      2.095412655991      3.952019316413
C     0.831590305902      0.068290267430      5.757841218715
H     1.144832538993     -2.038831960570      5.453545865620
H     0.365601803591      2.165242040862      5.879210596247
Cl    1.894683304525      0.127069964838      7.117996358606
*

