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

Single point

1 1
 P                 -0.02168500   -1.26342300   -2.09843300
 Au                 0.09479900    0.61877000   -0.68420200
 C                 -1.04351500   -1.04209800   -3.60888200
 H                 -0.62892900   -0.23087800   -4.21423500
 H                 -1.05450600   -1.96575800   -4.19679400
 H                 -2.06679700   -0.78018700   -3.32489000
 C                 -0.73954100   -2.73918100   -1.27189800
 H                 -1.76495100   -2.51859200   -0.96161000
 H                 -0.74163300   -3.59722800   -1.95167200
 H                 -0.15296400   -2.97498700   -0.38037900
 C                  1.60467600   -1.83757300   -2.73165200
 H                  2.25653100   -2.08856800   -1.89000000
 H                  1.47662900   -2.71888700   -3.36884100
 H                  2.07294400   -1.03657900   -3.31080400
 C                  0.20827300    2.25012400    0.59438400
 C                  0.46720800    2.04305000    2.06551400
 H                  0.60377000    2.97527800    2.62691800
 C                  0.14973100    3.52590700    0.17065100
 H                 -0.01390600    3.77925100   -0.87389100
 H                  0.28002600    4.37457600    0.84780800
 H                 -1.56934200    1.95287000    2.65525600
 H                 -0.52929500    1.28735800    3.76979400
 N                 -0.73099100    1.37087600    2.76257100
 N                 -1.07105600    0.04948300    2.33905600
 H                 -1.17854000    0.01241500    1.32115400
 C                 -0.21797500   -0.91569400    2.89882400
 O                  0.43468100   -0.70641800    3.90313300
 O                 -0.29558900   -2.03904500    2.19799100
 C                  0.45888600   -3.16165000    2.72428800
 H                  0.11132400   -3.40334500    3.73043200
 H                  0.25874600   -3.98179700    2.03732500
 H                  1.52290600   -2.91792800    2.74102700
 H                  1.30603500    1.37351000    2.26939300

-C -H -N -P -O -Si 0
6-311+G(d,p)
****
Au 0
SDD
****

Au
SDD



