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

Opt freq

0 1
 C                  0.61779787   -1.49046708   -1.70855937
 C                  1.44396466   -2.34161597   -0.75455067
 C                 -0.71316231   -2.14348839   -1.95463511
 H                 -1.27959683   -1.84615491   -2.83360122
 N                 -0.52895895   -3.54934583   -0.01578789
 C                 -1.24964368   -3.97659833    1.17368626
 H                 -1.57209021   -3.12180344    1.78448353
 H                 -2.13109626   -4.55566180    0.87967101
 H                 -0.60383421   -4.61946651    1.78101005
 C                  0.81350336   -3.22397841    0.07359202
 H                  1.34686004   -3.76465873    0.85106653
 C                 -1.24649872   -3.04831157   -1.11961046
 H                 -2.22652654   -3.49298436   -1.26563119
 H                  1.15671716   -1.36716073   -2.65681374
 P                 -0.33504751    2.53866859    0.07548531
 Au                 0.23472799    0.45747502   -0.91448801
 C                 -1.92016249    2.49632569    1.00817838
 H                 -1.87424108    1.68189266    1.73615239
 H                 -2.10389264    3.44903467    1.51668265
 H                 -2.73992401    2.29132047    0.31288199
 C                 -0.53475850    3.95678734   -1.08085783
 H                 -1.30915425    3.71933911   -1.81622456
 H                 -0.81716065    4.86485259   -0.53720129
 H                  0.40672266    4.12996664   -1.61079686
 C                  0.88008174    3.16397834    1.30994715
 H                  1.85630423    3.28640595    0.83167569
 H                  0.55402680    4.12444756    1.72344671
 H                  0.98294198    2.43973042    2.12239602
 H                  1.16637272   -1.33751157    1.23367654
 O                  1.34614877   -0.89167371    2.09642922
 C                  0.18450915   -0.48699121    2.63398315
 O                 -0.89537658   -0.62686783    2.08414301
 C                  0.38194664    0.13981179    3.99234429
 H                 -0.53206267    0.64709493    4.30308139
 H                  0.62375568   -0.64543961    4.71763912
 H                  1.22259274    0.83952580    3.97855519
 H                  2.50655554   -2.22228431   -0.71504643

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

Au
SDD



