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

Opt freq

1 1
 P                  0.08063895   -0.11844513   -3.65731694
 Au                 0.49573004    0.17180848   -1.35976208
 C                 -0.79933247    1.28705489   -4.44992436
 H                 -0.20019115    2.19622993   -4.34619689
 H                 -0.96894101    1.08273595   -5.51223218
 H                 -1.76025311    1.44236927   -3.95115881
 C                 -0.96444770   -1.58094244   -4.04176173
 H                 -1.92734703   -1.48390595   -3.53183583
 H                 -1.13057755   -1.66117920   -5.12120687
 H                 -0.46791679   -2.48703483   -3.68267507
 C                  1.58240410   -0.35064544   -4.68973187
 H                  2.12807947   -1.23410206   -4.34600562
 H                  1.30667035   -0.47974446   -5.74156104
 H                  2.23185637    0.52359783   -4.58877272
 C                  0.84473311    0.41859740    0.67612383
 C                  0.06655606   -0.54123319    1.55268343
 H                  0.28708635   -1.55648427    1.19674613
 C                  1.67775221    1.34747754    1.16680539
 H                  2.23840097    2.01323928    0.51627761
 H                  1.86011721    1.51287197    2.22887619
 C                 -1.44878854   -0.36074237    1.49791185
 C                 -2.02425387    0.87083834    1.15466212
 C                 -2.28800151   -1.43973798    1.80851251
 C                 -3.41291773    1.02245885    1.13634875
 H                 -1.38191635    1.70626019    0.89448570
 C                 -3.67535224   -1.28934048    1.79142189
 H                 -1.85634331   -2.40728970    2.05777943
 C                 -4.24132635   -0.05521916    1.45713151
 H                 -3.84453026    1.98278294    0.86927607
 H                 -4.31250545   -2.13507893    2.03286683
 H                 -5.32086736    0.06282403    1.44284108
 N                  0.37856020    0.40855069    4.01343437
 C                 -0.87679628    1.09374662    4.34579492
 H                 -1.61793280    0.33552854    4.60460290
 H                 -0.67795758    1.76109238    5.18285655
 H                 -1.20711069    1.64336654    3.46414068
 C                  0.53504631   -0.69969555    3.06566292
 H                 -0.03675864   -1.53774525    3.47925934
 C                  2.00467964   -0.97519017    3.21685963
 O                  2.75486554   -1.74344021    2.72240351
 O                  2.45398150   -0.02843865    4.23203313
 C                  1.42939215    0.71515514    4.64445634
 H                  1.50990187    1.46315698    5.40531864

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

Au 0
SDD



