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

Opt freq

1 1
 P                  0.22059748    0.08351538   -2.95785039
 Au                -0.42473844   -0.10589466   -0.69141302
 C                  0.73409697    1.78048889   -3.43026141
 H                  1.57312175    2.09462093   -2.80311747
 H                  1.03608368    1.80437470   -4.48224713
 H                 -0.10024239    2.47021481   -3.27478988
 C                 -1.10081957   -0.36100334   -4.15177945
 H                 -1.96625492    0.28967966   -3.99802172
 H                 -0.73497678   -0.24416518   -5.17714920
 H                 -1.40613185   -1.39863632   -3.98974572
 C                  1.64390743   -0.98508721   -3.40389660
 H                  1.38648198   -2.03142680   -3.21730510
 H                  1.89805312   -0.85463341   -4.46070273
 H                  2.50610271   -0.71917404   -2.78588905
 C                 -0.91728846   -0.24034954    1.27862456
 C                 -0.55340725   -1.40177374    2.08861595
 H                 -0.21344236   -2.26864883    1.52237656
 C                 -1.30655797    0.93874777    2.06805241
 H                 -1.53846142    1.82081161    1.47099053
 H                 -2.11467772    0.75158653    2.78749866
 N                  0.23112697    0.17576195    3.89564514
 C                 -0.69028464   -0.09279530    4.98466088
 H                 -0.24792179   -0.84193613    5.64414314
 H                 -0.84826318    0.82913102    5.54870983
 H                 -1.66681131   -0.46385206    4.63474443
 C                  0.70493235   -0.84957787    3.03311374
 H                  1.15813552   -1.71013027    3.52086238
 C                  1.65127189   -0.04394217    2.14525183
 O                  2.60309133   -0.39015736    1.50169041
 O                  1.17462831    1.24304208    2.16311876
 H                 -1.30299352   -1.69674099    2.83289663
 N                 -0.00102534    1.25145943    2.99340704

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

Au
SDD



