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

Opt freq

1 1
 P                 -0.64495766   -0.05334505   -3.34618250
 Au                 0.30207889    0.06294616   -1.20109635
 C                 -1.91413501    1.23104885   -3.68861747
 H                 -1.46238514    2.22341062   -3.60228398
 H                 -2.32385285    1.10416794   -4.69615078
 H                 -2.72107285    1.14848170   -2.95476234
 C                 -1.50891438   -1.64070728   -3.67765140
 H                 -2.29568452   -1.78963396   -2.93262238
 H                 -1.95136310   -1.63425662   -4.67933384
 H                 -0.79401287   -2.46504475   -3.60154006
 C                  0.55056762    0.10746707   -4.73199325
 H                  1.30304520   -0.68273102   -4.65577940
 H                  0.03409497    0.02649130   -5.69411085
 H                  1.05345407    1.07685042   -4.66970203
 C                  1.11993841    0.15438809    0.71335451
 C                  0.83225262   -1.07061873    1.55083945
 H                  1.49470791   -1.87107254    1.20538384
 C                  1.89453008    1.17161777    1.12278578
 H                  2.12814444    2.00210621    0.46251285
 H                  2.35200548    1.25944876    2.11281925
 H                  2.14450629   -0.37427149    3.09458459
 H                  1.54411064   -1.85833569    3.40287609
 C                  0.29138054   -0.36797230    4.02215721
 C                 -0.43482711   -1.25962220    4.80867334
 C                  0.06910833    1.00609767    4.07318542
 C                 -1.40819890   -0.75976832    5.67341307
 H                 -0.25699703   -2.32861940    4.74007796
 C                 -0.90689654    1.49305394    4.94472054
 H                  0.62689372    1.68399847    3.43955073
 C                 -1.64556013    0.61525677    5.74142314
 H                 -1.97920137   -1.44696835    6.28941999
 H                 -1.08812071    2.56197256    4.99482828
 H                 -2.40493062    1.00182798    6.41400194
 N                  1.27828406   -0.92356627    3.07890256
 H                 -0.17667078   -1.42687705    1.54351936

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

Au
SDD



