%nprocshared=20
%mem=41GB
#p nosymm b3lyp genecp scrf=(pcm,solvent=dichloromethane) empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

single point

1 1
 C                 -1.21427300   -0.06532100   -1.35339000
 C                 -0.59087600    1.23851700   -0.77504500
 C                  1.11874300    0.01204900   -2.35402800
 H                  1.58612600    0.81201600   -2.94623400
 H                  1.44523300   -0.94241700   -2.78695400
 C                 -0.37011100    0.07608400   -2.47937300
 H                 -0.75743100    0.27204400   -3.48093400
 C                 -1.24709300    2.41689500   -0.97906000
 C                  0.77845100    1.08764200   -0.15611400
 H                  0.70942900    0.72680500    0.87442600
 H                  1.32087000    2.03965100   -0.17275600
 H                 -2.27065900    0.05473700   -1.59925500
 H                 -2.11774700    2.37664300   -1.63170200
 C                 -0.96950800    3.72420400   -0.40883300
 C                 -0.25228200    3.93181800    0.78682000
 C                 -1.46664500    4.86831800   -1.07958200
 C                  0.00601300    5.21114300    1.27089400
 H                  0.07090100    3.08484700    1.38172300
 C                 -1.20702300    6.14468300   -0.61598100
 H                 -2.04805600    4.74074800   -1.98889100
 C                 -0.45887800    6.33103700    0.56247900
 H                  0.55022500    5.32488500    2.20052100
 H                 -1.57483100    7.02052500   -1.14055000
 O                 -0.26032300    7.61669800    0.93444100
 C                  0.48202000    7.88068900    2.12694500
 H                  0.52146400    8.96675600    2.21590200
 H                 -0.01834900    7.45900400    3.00677400
 H                  1.50076300    7.48134600    2.05631500
 Au                -0.92176500   -1.84501500   -0.17376600
 P                 -0.50130400   -3.76137700    1.08701900
 C                 -1.94870900   -4.82832400    1.45349000
 C                  0.71640700   -4.85933200    0.26429500
 C                  0.23795500   -3.37853200    2.72106100
 H                 -2.39995100   -5.16891200    0.51737200
 H                 -1.63688800   -5.69566900    2.04452600
 H                 -2.69176300   -4.25481700    2.01485600
 H                  0.28822100   -5.24203800   -0.66683500
 H                  0.97618600   -5.69777500    0.91880500
 H                  1.60851500   -4.27461000    0.02447300
 H                  0.49218400   -4.30423400    3.24787500
 H                  1.13608100   -2.77614700    2.56376400
 H                 -0.47573700   -2.80319900    3.31789000
 N                  1.48913900    0.07216800   -0.95221300
 S                  2.55978900   -1.00414200   -0.26394400
 O                  2.22847500   -1.09639100    1.16465500
 O                  2.56595500   -2.21183300   -1.10269900
 C                  4.16797700   -0.21272400   -0.40968900
 H                  4.13425400    0.73472300    0.13160600
 H                  4.90850500   -0.88303700    0.03235800
 H                  4.37753800   -0.05164200   -1.46879100

C H P N S O 0
6-311+G(d,p)
****
Au 0
SDD
****

Au 0
SDD




