%chk=000085202.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085202

0 1
 Br  -8.403500      0.4549000      4.5000002E-02
 Cl   7.316800      0.8643000     -5.1600002E-02
 O    5.950400      -1.405200      7.8999996E-03
 C  -0.4537000      0.5231000     -1.3000000E-03
 C   -1.690300     -0.3798000      1.7400000E-02
 C   0.8342000     -0.3046000      9.6000005E-03
 C   -3.010400      0.3980000      1.8999999E-02
 C    2.106400      0.5481000      2.1400001E-02
 C   -4.244900     -0.5057000     -3.9099999E-02
 C    3.393300     -0.2782000      5.8699999E-02
 C   -5.563600      0.2737000     -2.4200000E-02
 C    4.629800      0.6191000     -4.3000001E-03
 C   -6.786300     -0.6288000     -4.7899999E-02
 C    5.921800     -0.1788000     -1.0600000E-02
 H  -0.4746000       1.159600     -0.8939000    
 H  -0.4716000       1.186900      0.8712000    
 H   -1.656400      -1.026700      0.9029000    
 H   -1.665300      -1.040200     -0.8583000    
 H   0.8362000     -0.9573000      0.8915000    
 H   0.8507000     -0.9606000     -0.8695000    
 H   -3.058400       1.021300      0.9202000    
 H   -3.026800       1.080500     -0.8397000    
 H    2.083000       1.217300      0.8904000    
 H    2.111200       1.187600     -0.8702000    
 H   -4.224900      -1.195200      0.8140000    
 H   -4.200900      -1.121300     -0.9460000    
 H    3.417800     -0.8841000      0.9726000    
 H    3.402500     -0.9786000     -0.7856000    
 H   -5.588600      0.9540000     -0.8850000    
 H   -5.590300      0.9075000      0.8716000    
 H    4.599500       1.226200     -0.9164000    
 H    4.641100       1.289800      0.8625000    
 H   -6.847800      -1.210100     -0.9717000    
 H   -6.813500      -1.302900      0.8125000    


%chk=000085202-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085202

0 1
Br -8.562379 0.514192 -0.021313
Cl 7.463784 1.090635 0.027021
O 6.195414 -1.343728 0.016471
C -0.456250 0.451508 -0.000013
C -1.721712 -0.435472 -0.004464
C 0.856670 -0.363331 0.002715
C -3.034373 0.379835 -0.006614
C 2.121352 0.524740 0.007090
C -4.299325 -0.509623 -0.012100
C 3.428887 -0.298364 0.010372
C -5.606082 0.326782 -0.013679
C 4.672420 0.615396 0.014442
C -6.839436 -0.576905 -0.019425
C 5.980220 -0.140095 0.018278
H -0.472933 1.118037 -0.887492
H -0.477779 1.116087 0.888840
H -1.704998 -1.102252 0.882801
H -1.700558 -1.099702 -0.893547
H 0.872986 -1.029599 0.890105
H 0.877816 -1.027772 -0.885936
H -3.056767 1.042818 0.882898
H -3.051671 1.046393 -0.893557
H 2.098067 1.188890 0.896163
H 2.103328 1.190218 -0.881103
H -4.282884 -1.175057 0.875695
H -4.278106 -1.170878 -0.902916
H 3.452754 -0.961480 0.896296
H 3.457832 -0.960532 -0.876117
H -5.624029 0.987185 -0.901267
H -5.628992 0.982732 0.877096
H 4.683636 1.288516 -0.865488
H 4.678169 1.288514 0.894351
H -6.908577 -1.199594 -0.925131
H -6.913585 -1.204294 0.882628


