%nprocshared=8
%mem=22GB
#p opt freq b3lyp genecp nosymm empiricaldispersion=gd3 scrf=(pcm,solvent=dichloromethane) scf=maxcyc=512

Opt freq

1 1
 C                 -1.13511916    0.04024694    2.73843562
 C                 -0.42332753   -1.14831827    2.86409319
 N                 -0.27740494    1.01825035    2.23443269
 H                 -2.16530886    0.25068109    2.96708322
 O                  0.93955037   -0.77569311    2.38492085
 O                 -0.61751352   -2.30424179    3.23258228
 C                 -0.65865708    2.40301653    1.96346775
 H                 -1.46280884    2.41558733    1.22522945
 H                 -1.00129256    2.86829723    2.88970887
 H                  0.20585329    2.94311927    1.57686570
 C                  0.91524712    0.50002353    2.04482168
 H                  1.83854615    1.04940042    1.93951119
 P                 -0.23745521   -0.18463650   -2.37124523
 Au                 0.31143785    0.09435294   -0.10800147
 C                  0.30031107    1.21200450   -3.43542684
 H                  1.38682913    1.31945623   -3.37391586
 H                  0.00923190    1.03068687   -4.47528118
 H                 -0.16500427    2.13718142   -3.08364532
 C                 -2.03535787   -0.35044400   -2.70485752
 H                 -2.55674685    0.54129297   -2.34563751
 H                 -2.20969780   -0.46629554   -3.77966890
 H                 -2.42608770   -1.22457207   -2.17657754
 C                  0.51455940   -1.67459352   -3.13592739
 H                  0.16779892   -2.56704554   -2.60724011
 H                  0.23294299   -1.74455586   -4.19158838
 H                  1.60358690   -1.61745638   -3.05274163

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

Au 0
SDD



