%chk=000113925.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113925

0 1
 Br  -1.134800       2.728400      4.7600001E-02
 O   0.2424000      3.0400001E-02 -0.7055000    
 O    2.990400      0.1464000      -1.342500    
 O    4.834900      0.1340000      0.7278000    
 C    2.544600      0.1009000      1.5000000E-02
 C    1.221000     -0.6533000      7.0400000E-02
 C    3.618400     -0.5972000      0.8392000    
 C   -1.063700     -0.1238000     -0.3240000    
 C   -1.840500      0.9693000      4.8300002E-02
 C   -1.602400      -1.407100     -0.3162000    
 C   -3.167900      0.7774000      0.4316000    
 C   -2.929900      -1.598800      6.7199998E-02
 C   -3.712500     -0.5066000      0.4412000    
 H    2.418300       1.141300      0.3327000    
 H   0.8951000     -0.7411000       1.115000    
 H    1.342100      -1.659400     -0.3488000    
 H    3.809500      -1.614000      0.4801000    
 H    3.340500     -0.6429000       1.896300    
 H   -1.009600      -2.267200     -0.6146000    
 H    3.105700     -0.7684000      -1.651700    
 H   -3.793000       1.616600      0.7259000    
 H   -3.354800      -2.598300      7.2400004E-02
 H   -4.746100     -0.6562000      0.7391000    
 H    5.066800      0.1718000     -0.2160000    


%chk=000113925-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113925

0 1
Br -1.273581 2.776388 -0.667015
O 0.322671 0.312142 0.163418
O 2.820944 0.498348 -1.074079
O 5.115906 -0.294296 0.215271
C 2.671862 -0.050293 0.285593
C 1.317357 -0.745750 0.432102
C 3.863524 -1.007203 0.445918
C -1.030199 -0.032590 0.128260
C -1.947430 0.991528 -0.229361
C -1.530948 -1.323862 0.432107
C -3.330223 0.740156 -0.279044
C -2.919313 -1.576875 0.380638
C -3.822126 -0.551269 0.027945
H 2.746924 0.769896 1.029278
H 1.182020 -1.150173 1.455590
H 1.208275 -1.557378 -0.314935
H 3.748346 -1.854075 -0.265270
H 3.919189 -1.399102 1.475565
H -0.843466 -2.128353 0.709398
H 2.067897 1.119851 -1.245143
H -4.016264 1.545707 -0.557197
H -3.290715 -2.579291 0.618160
H -4.898470 -0.744162 -0.012024
H 4.992320 0.222855 -0.624676


