%nproc=20
%Mem=40000MB
%Chk=AC01-Br-Int10
#p SCRF=(PCM,Solvent=Dichloromethane) B3LYP/genecp opt EmpiricalDispersion=GD3 freq=noraman nosymm
# scf(maxcyc=100) gfinput gfprint

opt freq

0 1
 C                  2.32383195    2.66962350   -0.39078366
 C                  1.66965454    1.55962930    0.16265756
 C                  2.42060315    0.48532244    0.64969470
 C                  4.45408567    1.60719451   -0.07672733
 H                  1.93918383   -0.35662996    1.13669817
 H                  5.53638619    1.61588320   -0.16812393
 C                  0.18844208    1.78764867    0.11878521
 C                 -0.69224263    0.73950018    0.03379529
 C                  1.32534355    3.74606561   -0.72544859
 H                  1.19062990    3.87449342   -1.81016092
 H                  1.60949901    4.72493123   -0.32683961
 C                  0.03780588    3.23479299   -0.10339472
 C                 -1.96424271    3.77497528    1.34067899
 H                 -1.74036858    4.47752022    2.15313906
 H                 -3.00524504    3.93344178    1.04541995
 H                 -1.85387812    2.76359537    1.73081580
 C                 -0.79529625    5.58473309   -0.00156561
 H                 -1.76587102    6.08986375    0.02882770
 H                 -0.18468422    5.99196643    0.81363225
 H                 -0.31407018    5.83785211   -0.94968294
 P                  0.15935427   -3.59044340   -0.01354287
 C                 -1.12928364   -4.64926774    0.75422655
 H                 -0.83069580   -5.70175453    0.70925230
 H                 -1.26793458   -4.35496648    1.79839941
 H                 -2.07590203   -4.51546374    0.22320619
 C                  1.70779229   -4.03298118    0.86978278
 H                  1.88017177   -5.11313588    0.81945383
 H                  2.55029596   -3.50709567    0.41152472
 H                  1.63001369   -3.72514820    1.91654551
 C                  0.37862539   -4.27412687   -1.70372067
 H                 -0.54100880   -4.12753620   -2.27717307
 H                  1.19364853   -3.74559150   -2.20618869
 H                  0.61218554   -5.34266777   -1.65537343
 Au                -0.29763342   -1.29660542    0.02918316
 C                  3.81193946    0.51535991    0.52004392
 H                  4.40062277   -0.31464129    0.90086985
 C                  3.70755494    2.70085871   -0.52782065
 H                  4.20036023    3.56573599   -0.96382436
 Br                -2.59126737    1.05882227   -0.34534770
 C                 -1.00232292    4.07717955    0.18886711

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




