%chk=000122956.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122956

0 1
 Br  -3.307600      -2.289600     -0.2719000    
 O    2.090700      -2.062600       1.037500    
 N   0.5213000       2.320400      0.2006000    
 C    1.441700      0.4026000     -0.4334000    
 C   4.8000000E-02  0.1861000     -0.2445000    
 C  -0.5058000       1.404700      0.1537000    
 C    2.438300     -0.6026000     -0.8556000    
 C    1.702000       1.724100     -0.1527000    
 C  -0.7979000     -0.9332000     -0.3741000    
 C    3.089500      -1.354400      0.3145000    
 C   -1.868700       1.560500      0.4306000    
 C   -2.163400     -0.7924000     -0.1003000    
 C   -2.688200      0.4363000      0.2957000    
 H    1.956700      -1.330500      -1.520700    
 H    3.226900     -0.1185000      -1.444900    
 H    2.620100       2.294700     -0.1712000    
 H   0.4178000       3.291900      0.4590000    
 H  -0.3898000      -1.891700     -0.6833000    
 H    3.814900      -2.081000     -6.3699998E-02
 H    3.606000     -0.6737000      0.9995000    
 H   -2.278100       2.516600      0.7388000    
 H   -3.750200      0.5411000      0.5073000    
 H    1.585800      -1.414600       1.557200    


%chk=000122956-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122956

0 1
Br -3.278589 -2.380010 -0.139437
O 2.000835 -2.259311 0.934746
N 0.497100 2.431172 0.147001
C 1.493331 0.456759 -0.457566
C 0.076315 0.217477 -0.219374
C -0.521475 1.474048 0.155819
C 2.532601 -0.564495 -0.853435
C 1.703031 1.817410 -0.224144
C -0.742908 -0.943998 -0.310580
C 3.046849 -1.419809 0.334953
C -1.897256 1.597487 0.447107
C -2.107511 -0.797891 -0.022715
C -2.696996 0.440825 0.355532
H 2.117722 -1.251940 -1.615449
H 3.404710 -0.059858 -1.313402
H 2.622596 2.394548 -0.307589
H 0.381002 3.419095 0.360464
H -0.321453 -1.910955 -0.598439
H 3.805125 -2.138038 -0.020158
H 3.509849 -0.760010 1.099467
H -2.346086 2.554304 0.734270
H -3.767434 0.491203 0.571907
H 1.298642 -1.673815 1.319121


