%nprocshared=24
%mem=41GB
#p opt freq b3lyp genecp scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=maxcyc=512

Opt freq

1 1
 P                  0.04496388    0.00766744   -3.35153692
 Au                -0.04836683   -0.02442804   -0.98764678
 C                 -0.09611598    1.69013860   -4.06586105
 H                  0.72974131    2.30765582   -3.70192822
 H                 -0.05597752    1.62952506   -5.15831195
 H                 -1.04467506    2.13833327   -3.75673914
 C                 -1.28793774   -0.96656828   -4.14926330
 H                 -2.26123685   -0.55410164   -3.87129752
 H                 -1.16983029   -0.92117968   -5.23680837
 H                 -1.23868907   -2.00676605   -3.81726973
 C                  1.61388731   -0.66079587   -4.02707725
 H                  1.76699464   -1.68857465   -3.68455815
 H                  1.58498402   -0.64100384   -5.12146728
 H                  2.44790084   -0.04559894   -3.67757078
 C                 -0.12352226   -0.06116107    1.05882324
 C                  0.53347656   -1.12315248    1.84899932
 H                  1.58394900   -1.20611660    1.53051300
 C                 -0.89018496    0.95803178    1.80980643
 H                 -0.52517240    1.95837649    1.54279834
 H                 -1.92430053    0.92914601    1.43308371
 N                 -0.99855324   -0.51868626    3.63018841
 C                 -1.43676779   -0.68230039    5.02380953
 H                 -0.73960170   -0.22389419    5.73891576
 H                 -2.41977965   -0.22173962    5.12904436
 H                 -1.51564755   -1.75207795    5.23086812
 C                  0.37159704   -0.97227391    3.37092188
 H                  0.62776208   -1.88684040    3.90275683
 C                  1.21657852    0.22684508    3.83557580
 O                  2.37324130    0.26841002    4.16634624
 O                  0.41581563    1.32723148    3.76004197
 H                  0.08313828   -2.06934714    1.50033086
 C                 -0.94986206    0.84552883    3.28132997
 H                 -1.81251318    1.40892533    3.56997756

-C -H -N -P -O 0
6-31G(d)
****
Au 0
SDD
****

Au
SDD





