%nproc=20
%Mem=40000MB
%Chk=IE17_U
#p SCRF=(PCM,Solvent=dichloromethane) BP86/genecp opt EmpiricalDispersion=GD3 freq=noraman nosymm 
# scf(maxcyc=100) gfinput gfprint

opt freq

0 1
 Au                 5.29110000   10.13290000   13.30140000
 Fe                 4.22240000   10.54650000   17.29230000
 P                  3.29820000   10.86970000   13.96740000
 Cl                 7.33910000    9.25380000   12.81970000
 N                  4.92420000   15.36100000   12.81280000
 C                  5.58400000   14.25380000   13.35060000
 C                  2.61770000   13.62290000    9.49470000
 H                  2.73160000   12.74460000    9.07510000
 H                  3.44510000   14.13960000    9.40050000
 H                  1.88240000   14.10090000    9.05740000
 C                  5.14190000   14.04730000   14.64070000
 C                  4.05090000   15.85320000   13.74950000
 C                  6.57510000   13.50910000   12.55940000
 C                  5.76630000   10.04250000   18.53050000
 H                  6.26780000   10.64400000   19.06820000
 C                  3.94620000   12.54870000   17.59840000
 H                  4.41670000   13.09570000   18.21650000
 C                  7.30330000   12.56080000   10.45860000
 C                  4.16850000    8.57650000   17.82180000
 H                  3.40400000    8.01300000   17.79900000
 C                  5.54560000   12.91290000   15.55920000
 H                  5.96010000   12.20120000   14.99210000
 C                  3.33630000   11.42620000   15.67740000
 C                  0.30130000    7.39720000   13.67370000
 H                 -0.28790000    6.65630000   13.59400000
 C                  5.08010000    8.75920000   16.77330000
 H                  5.03650000    8.34720000   15.91840000
 C                  3.16400000   16.92610000   13.64300000
 H                  3.09400000   17.43160000   12.84160000
 C                  2.35710000   11.14960000   16.69630000
 H                  1.59000000   10.59760000   16.60010000
 C                  4.15950000   15.05910000   14.91570000
 C                  2.09820000    8.48530000   14.80660000
 H                  2.74570000    8.49940000   15.50160000
 C                  2.74390000   11.85140000   17.87460000
 H                  2.27670000   11.85180000   18.70180000
 C                  6.07830000    9.66520000   17.20990000
 H                  6.82390000    9.96440000   16.70300000
 C                  3.36850000   15.40070000   16.02500000
 H                  3.43420000   14.90340000   16.83180000
 C                  0.22640000    8.42700000   12.74580000
 C                  7.76660000   13.08590000   13.14280000
 H                  7.94130000   13.28260000   14.05560000
 C                  1.42520000   14.29980000   11.59100000
 H                  1.05500000   15.02500000   11.10160000
 C                  1.10280000    9.50460000   12.87000000
 H                  1.05240000   10.22380000   12.25140000
 C                  5.21790000   16.06680000   11.57250000
 H                  6.08840000   15.77570000   11.22930000
 H                  5.24000000   17.03160000   11.74300000
 H                  4.52280000   15.86780000   10.91100000
 C                  2.30180000   13.44410000   10.95380000
 C                  6.59260000   13.34050000   16.60020000
 H                  6.21370000   14.03510000   17.17830000
 H                  7.38400000   13.69270000   16.14190000
 H                  6.84770000   12.56610000   17.14400000
 C                  1.22000000    7.42640000   14.71730000
 C                  8.70070000   12.37800000   12.39850000
 C                  4.34290000   12.30260000   16.24570000
 C                  8.50880000   12.14840000   11.03430000
 C                  2.49200000   16.46880000   15.93230000
 H                  1.94960000   16.69610000   16.67840000
 C                  1.66100000   13.10700000   13.64050000
 H                  1.44390000   12.98950000   14.55790000
 C                  4.57690000    9.37370000   18.92420000
 H                  4.13850000    9.44570000   19.76390000
 C                  2.56630000   12.24990000   13.03610000
 C                  2.04940000    9.53980000   13.88790000
 C                  0.02730000   15.02470000   13.54110000
 H                  0.14370000   15.03340000   14.51410000
 H                 -0.86550000   14.68500000   13.32190000
 H                  0.12510000   15.93520000   13.19220000
 C                  6.34760000   13.21400000   11.20040000
 H                  5.52760000   13.46840000   10.79360000
 C                  1.06660000   14.13690000   12.92070000
 C                  2.88180000   12.40800000   11.69660000
 H                  3.49340000   11.81190000   11.28050000
 C                  2.39390000   17.22270000   14.74720000
 H                  1.78460000   17.95050000   14.70770000
 C                  1.21210000    6.33850000   15.76860000
 H                  2.10190000    6.26890000   16.17340000
 H                  0.97480000    5.48360000   15.35230000
 H                  0.55450000    6.55820000   16.46120000
 C                 -0.77400000    8.37250000   11.61340000
 H                 -0.91270000    9.27460000   11.25640000
 H                 -1.62510000    8.01840000   11.94610000
 H                 -0.43260000    7.78920000   10.90380000
 H                  7.19628592   12.31161670    9.42353688
 H                  9.22115642   11.61772828   10.43778021
 H                  9.60148945   11.98159014   12.81842570

C H P N Cl 0
6-31G*
****
Au Fe 0
SDD 
****

Au Fe 0
SDD


