%nproc=20
%Mem=40000MB
%Chk=AC01-Br-Int11
#p SCRF=(PCM,Solvent=Dichloromethane) B3LYP/genecp opt EmpiricalDispersion=GD3 freq=noraman nosymm
# scf(maxcyc=100) gfinput gfprint

opt freq

0 1
 C                  2.34563829    2.81857933   -0.13395540
 C                  1.72367077    1.57712924    0.11058179
 C                  2.52239198    0.46471386    0.39483412
 C                  4.51833004    1.83846316    0.13404628
 H                  2.08056969   -0.49899884    0.62733544
 H                  5.60093858    1.92558097    0.14756826
 C                  0.23945881    1.77131894    0.03223348
 C                 -0.63861754    0.70756634    0.05846231
 C                  1.29145690    3.80623789   -0.42487375
 H                  1.44849185    4.87606261   -0.29934550
 C                  0.03261901    3.20763429   -0.18865605
 C                 -1.71151083    4.25471826    1.22193432
 H                 -0.98997493    4.89077952    1.74630913
 H                 -2.67851179    4.76800950    1.20524501
 H                 -1.82532701    3.32296777    1.78209218
 C                 -1.11774935    5.32629955   -1.00012384
 H                 -2.10448397    5.79593501   -1.06189182
 H                 -0.45001291    6.03309905   -0.49514896
 H                 -0.75218976    5.16966954   -2.02061867
 P                  0.13984659   -3.63475032   -0.10784606
 C                 -0.96282603   -4.64142160    0.96009951
 H                 -0.71438944   -5.70396579    0.87097110
 H                 -0.84717378   -4.32631758    2.00095428
 H                 -2.00211914   -4.48360111    0.65874441
 C                  1.84216968   -4.09926356    0.39929269
 H                  1.98675325   -5.18062133    0.30678935
 H                  2.56430213   -3.57926982   -0.23656523
 H                  2.00671963   -3.79718300    1.43753290
 C                 -0.05697168   -4.34054934   -1.79106347
 H                 -1.08186207   -4.17760806   -2.13610995
 H                  0.62924320   -3.83778318   -2.47837236
 H                  0.15880053   -5.41393373   -1.78122816
 Au                -0.26001782   -1.32962666    0.00368351
 C                  3.91345687    0.60324093    0.40056062
 H                  4.53181131   -0.26114629    0.62588718
 C                  3.73166807    2.96077028   -0.13655032
 H                  4.18732275    3.92715848   -0.33614707
 Br                -2.56813998    1.00534248    0.07641782
 C                 -1.24184628    3.99900772   -0.23370435
 H                 -2.00833214    3.39926804   -0.73063919

C H P 0
6-31G*
****
Br 0
LANL2DZ
D 1 1.0
0.428 1.0
****
Au 0
SDD 
****

Br 0
LANL2DZ
Au 0
SDD




