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

Single point

1 1
 P                  0.19310800   -0.45002200   -2.94871000
 Au                 0.73894900    0.25125500   -0.80318600
 C                 -1.40282600    0.27137800   -3.49878000
 H                 -1.30026500    1.35755200   -3.57682100
 H                 -1.69303400   -0.13982100   -4.47111400
 H                 -2.17467900    0.04778500   -2.75685700
 C                 -0.03523100   -2.26561800   -3.08074700
 H                 -0.80776000   -2.58730700   -2.37666100
 H                 -0.33332700   -2.53513000   -4.09920900
 H                  0.90150700   -2.77042400   -2.82868500
 C                  1.39240100   -0.02577700   -4.27081500
 H                  2.35813100   -0.48951400   -4.05088900
 H                  1.02766100   -0.38592000   -5.23853600
 H                  1.52315300    1.05911500   -4.31141400
 C                  0.89973000    0.95346300    1.22851800
 C                 -0.24424500    0.63164700    2.20244300
 C                  1.50032000    2.17109100    1.28702800
 H                  2.37155300    2.40888000    0.68173000
 H                  1.12421100    2.98201900    1.91768600
 N                  1.67608700   -0.44610300    3.18713200
 C                  2.17449100    0.58758800    4.07557200
 H                  1.68418700    0.48217400    5.04386400
 H                  3.25117800    0.45955800    4.19768800
 H                  1.97789800    1.59144400    3.66722100
 C                  0.23440200   -0.67466700    2.97184000
 H                 -0.31538500   -0.89413900    3.88408700
 C                  0.31564400   -1.85678000    2.01269800
 O                 -0.45457000   -2.72600800    1.73319000
 O                  1.55779000   -1.73524400    1.38382700
 C                  2.16297900   -0.64036100    1.94756100
 H                  3.18644200   -0.44625200    1.65884800
 H                 -0.28005900    1.40084300    2.98716500
 C                 -1.62559100    0.55911500    1.56249400
 C                 -1.99665300    1.55199600    0.63859200
 C                 -2.55921500   -0.43545200    1.88103300
 C                 -3.25070100    1.53167200    0.02771700
 H                 -1.29628400    2.34376800    0.39256700
 C                 -3.81680300   -0.45614800    1.27028500
 H                 -2.31658400   -1.21504000    2.59386700
 C                 -4.16501600    0.52067600    0.33647800
 H                 -3.51226100    2.30721500   -0.68677700
 H                 -4.52173400   -1.24159100    1.52767000
 H                 -5.14091900    0.49998400   -0.14006000

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

Au
SDD



