%nprocshared=24
%mem=22GB
#p b3lyp genecp empiricaldispersion=gd3 scrf=(pcm,solvent=dichloromethane) integral(grid=superfine) nosymm scf=maxcyc=512

Single point

0 1
 P                  0.60686800    0.02104500   -3.28843800
 Au                 0.79357000    0.06399900   -0.93757300
 C                 -0.15659300   -1.51307600   -3.95698500
 H                 -1.16476100   -1.62719400   -3.54838400
 H                 -0.21277400   -1.46945000   -5.04975400
 H                  0.44135500   -2.37863700   -3.65760800
 C                  2.19227400    0.16541200   -4.20681100
 H                  2.85064500   -0.66255200   -3.92823900
 H                  2.01339500    0.14064800   -5.28682300
 H                  2.68244500    1.10625600   -3.94057900
 C                 -0.43969800    1.36838400   -3.97323200
 H                 -0.00521400    2.33702800   -3.70972500
 H                 -0.51240700    1.28549400   -5.06271800
 H                 -1.44037500    1.30623300   -3.53577100
 C                  0.86248400    0.09739200    1.15211900
 C                  0.39416000   -1.18954200    1.86649300
 H                  0.87685400   -2.07627800    1.44502500
 C                  0.14184200    1.27279600    1.77316200
 N                  0.13787600    0.14993700    3.89485300
 C                  0.21840400    0.27231700    5.34460600
 H                  1.24650600    0.48565500    5.66914700
 H                 -0.43370900    1.08279600    5.67898700
 H                 -0.11181700   -0.65935500    5.81455100
 C                  0.93473100   -0.91653700    3.26435400
 H                  0.99554100   -1.77030200    3.93978500
 C                  2.33404400   -0.34797000    2.92813700
 O                  3.31084500   -0.29402600    3.64592000
 O                  2.29916300    0.16129600    1.67683900
 C                 -0.14266300    1.23370400    3.11035500
 H                 -0.61184100    2.06922600    3.62394000
 H                 -0.68944600   -1.31932600    1.84450200
 H                  0.06257500    2.22165700    1.25072400
 H                 -1.59154000    1.08957200    0.99155800
 O                 -2.39742400    1.15850600    0.38426000
 C                 -2.79429700   -1.16824600   -0.84178200
 S                 -3.34045900   -0.14518700    0.52595400
 O                 -3.02670800   -0.82694300    1.78775400
 O                 -4.70801900    0.30177900    0.26433100
 H                 -1.73657000   -1.40020400   -0.70423400
 H                 -2.94817600   -0.61309600   -1.76836900
 H                 -3.39886900   -2.07774900   -0.83141600

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

Au
SDD



