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

Opt freq

1 1
 P                 -1.65541491    0.34237695   -2.98220827
 Au                -0.62308690   -0.20719262   -0.94479293
 C                 -0.81180317    1.67019089   -3.93124291
 H                  0.21141470    1.35908408   -4.16041296
 H                 -1.34751231    1.87379747   -4.86436724
 H                 -0.77373039    2.58169436   -3.32800270
 C                 -3.38406110    0.93869225   -2.79912516
 H                 -3.39680083    1.82633514   -2.16002094
 H                 -3.80944828    1.18749599   -3.77690950
 H                 -3.98958215    0.15949383   -2.32720482
 C                 -1.77791433   -1.05542207   -4.16861801
 H                 -2.34713748   -1.87052236   -3.71263555
 H                 -2.27608099   -0.73424004   -5.08934643
 H                 -0.77419936   -1.41933259   -4.40648086
 C                  0.28305946   -0.70201657    0.86265849
 C                 -0.68894750   -1.18131416    1.91208929
 H                 -1.06863699   -2.16737447    1.62441290
 C                  1.60995290   -0.63313791    1.06802331
 H                  2.12314672   -0.89461672    1.99842396
 H                  0.78981603   -2.15210147    3.14314466
 H                 -0.66850227   -1.94803357    3.92608922
 N                  0.01154678   -1.49951865    3.28712281
 N                  0.48409645   -0.37099505    4.01506584
 H                  0.86371596    0.34790563    3.40497760
 C                 -0.43396516    0.04534268    4.99420736
 O                 -1.28386784   -0.70254686    5.43972470
 O                 -0.18552082    1.29650976    5.34210249
 C                 -1.08506426    1.85830623    6.33281688
 H                 -1.05470263    1.26322582    7.24721187
 H                 -0.71402405    2.86576611    6.51097902
 H                 -2.09940524    1.88130365    5.92860859
 H                 -1.50865613   -0.52964944    2.13188662
 C                  2.56164758   -0.17863833   -0.05416534
 C                  2.88213339    1.17214718   -0.19250832
 C                  3.10331825   -1.11737025   -0.93218778
 C                  3.74357138    1.58410111   -1.20909098
 H                  2.45431830    1.91207214    0.49939275
 C                  3.96581287   -0.70557670   -1.94852384
 H                  2.85097222   -2.18206220   -0.82318525
 C                  4.28589285    0.64492620   -2.08718804
 H                  3.99573292    2.64886496   -1.31858530
 H                  4.39306946   -1.44600113   -2.64040365
 H                  4.96512881    0.96996662   -2.88861401

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

Au
SDD



