%chk=000052708.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052708

0 1
 Br   1.948500       2.550600     -0.2920000    
 Br   2.990300     -8.9599997E-02  -1.834300    
 Br   3.854100      0.4606000       1.227500    
 O   7.2600000E-02  8.5100003E-02 -0.4943000    
 O    1.448100      -1.516400      0.5570000    
 C   -1.113200     -0.5922000     -7.1400002E-02
 C   -2.210200     -0.3172000      -1.111600    
 C   -1.527600     -6.4599998E-02   1.311800    
 C   -2.623800       1.155400      -1.145100    
 C   -1.939500       1.407900       1.270800    
 C   -3.032600       1.656400      0.2363000    
 C  -0.8337000      -2.037200     -4.8000002E-03
 C    1.167100     -0.1231000      0.4034000    
 C    2.405800      0.6387000     -0.1031000    
 C  -0.6059000      -3.214500      4.9800001E-02
 H   -3.096200     -0.9306000     -0.8994000    
 H   -1.860700     -0.5984000      -2.113800    
 H  -0.7882000     -0.2243000       2.101300    
 H   -2.402800     -0.6396000       1.650800    
 H   -3.456900       1.286100      -1.845000    
 H   -1.793700       1.764000      -1.524100    
 H   -1.069300       2.034700       1.047000    
 H   -2.301300       1.712100       2.259800    
 H   -3.258000       2.727700      0.1883000    
 H   -3.953900       1.150000      0.5497000    
 H   0.9379000      0.2820000       1.392000    
 H  -0.4028000      -4.258800      9.8200001E-02
 H    2.105100      -1.762600     -0.1160000    


%chk=000052708-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052708

0 1
Br 1.750964 2.595115 -0.948367
Br 3.020435 -0.312599 -1.851225
Br 3.896937 1.075440 0.999802
O 0.145709 -0.061284 -0.502691
O 1.634036 -1.194175 1.020074
C -1.144790 -0.716613 -0.040954
C -2.159504 -0.292926 -1.139496
C -1.583479 -0.214885 1.362402
C -2.466098 1.219825 -1.100158
C -1.906550 1.297061 1.380373
C -2.949903 1.664075 0.299418
C -0.968610 -2.185114 -0.057800
C 1.212328 0.060405 0.458494
C 2.379485 0.797336 -0.294186
C -0.874813 -3.412699 -0.114693
H -3.086183 -0.878413 -0.982015
H -1.744942 -0.585973 -2.120444
H -0.815505 -0.480941 2.111827
H -2.491166 -0.787561 1.635627
H -3.229976 1.454322 -1.865788
H -1.549788 1.779205 -1.367847
H -0.986694 1.888337 1.200202
H -2.274271 1.574749 2.386495
H -3.136546 2.754451 0.309112
H -3.914635 1.167557 0.534232
H 0.945078 0.680407 1.334307
H -0.789881 -4.483392 -0.147227
H 1.747564 -1.859509 0.289327


