%chk=000033121.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033121

0 1
 Br -5.7999999E-03  -3.358100      -1.235100    
 Br   3.479900      -2.496800     -0.8864000    
 Br  -3.488700      -2.483700     -0.8884000    
 Br   3.192100       1.764600       1.840600    
 Br  -3.182900       1.774700       1.843800    
 Br  5.7000001E-03   3.615200      -2.405600    
 C  -3.8000001E-03  -1.876200      5.4099999E-02
 C    2.552100      -1.289400      0.3550000    
 C   -2.557200      -1.280800      0.3550000    
 C    1.790500       1.165800      0.5786000    
 C   -1.785700       1.171500      0.5792000    
 C   3.8000001E-03   2.212800     -0.9907000    
 C    1.275700      -1.951400      0.9165000    
 C   -1.283300      -1.947600      0.9164000    
 C    2.389800      7.9499997E-02 -0.3280000    
 C   -2.390300      8.8100001E-02 -0.3272000    
 C    1.307000       2.404000     -0.1890000    
 C   -1.298800       2.408100     -0.1888000    
 H  -2.4000001E-03 -0.9773000     -0.5552000    
 H    3.275200      -1.206000       1.174300    
 H   -3.280400      -1.195700       1.174000    
 H    1.012200      0.7783000       1.231300    
 H   -1.007800      0.7806000       1.230400    
 H   2.2000000E-03   1.285000      -1.565700    
 H    1.074500      -1.431100       1.862400    
 H    1.484000      -2.990300       1.204100    
 H   -1.495400      -2.986000       1.203200    
 H   -1.080600      -1.428700       1.862700    
 H    3.368000      0.4161000     -0.6997000    
 H    1.779600     -4.0800001E-02  -1.229800    
 H   -1.781400     -3.4000002E-02  -1.229600    
 H   -3.367600      0.4288000     -0.6975000    
 H    1.169000       3.246900      0.5019000    
 H    2.120800       2.713200     -0.8602000    
 H   -2.111700       2.719600     -0.8598000    
 H   -1.158100       3.250700      0.5019000    


%chk=000033121-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000033121

0 1
Br -0.006461 -3.414884 -1.290495
Br 3.594266 -2.512325 -0.905618
Br -3.602913 -2.499811 -0.906258
Br 3.147126 1.720650 1.969841
Br -3.139429 1.730495 1.971777
Br 0.005888 3.758360 -2.441368
C -0.003651 -1.904068 0.086830
C 2.564144 -1.290861 0.376967
C -2.569215 -1.282026 0.376910
C 1.754049 1.161099 0.558633
C -1.749700 1.166715 0.559020
C 0.003736 2.271750 -1.016774
C 1.287035 -1.962424 0.936009
C -1.294465 -1.957952 0.936100
C 2.374889 0.064924 -0.331146
C -2.375371 0.073325 -0.330812
C 1.324235 2.430995 -0.213849
C -1.315765 2.435422 -0.213083
H -0.002163 -1.009267 -0.553856
H 3.289522 -1.186642 1.200486
H -3.294409 -1.175602 1.200307
H 0.948138 0.774657 1.199123
H -0.944614 0.776719 1.198361
H 0.002060 1.361895 -1.641426
H 1.074639 -1.438477 1.894766
H 1.515180 -3.005755 1.215091
H -1.526223 -3.000502 1.215103
H -1.080319 -1.434790 1.894885
H 3.352666 0.419802 -0.701293
H 1.742171 -0.070246 -1.231258
H -1.743759 -0.063843 -1.231403
H -3.352058 0.432004 -0.700177
H 1.203863 3.275432 0.486825
H 2.142902 2.699013 -0.904388
H -2.133844 2.706716 -0.903033
H -1.191950 3.279101 0.487904


