%chk=000105395.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105395

0 1
 Br   3.127400       2.111500     -0.5502000    
 O   -2.002600      0.7520000       1.087100    
 O   -2.027200      9.5100001E-02  -1.188000    
 C   -1.620000     -0.2548000      0.1396000    
 C  -0.1127000     -0.3647000      0.2005000    
 C   0.6606000      0.7310000     -0.1435000    
 C   0.4622000      -1.559100      0.6006000    
 C    2.050600      0.6293000     -8.5600004E-02
 C    1.852000      -1.660700      0.6584000    
 C    2.646300     -0.5666000      0.3154000    
 C   -3.409900      0.9505000       1.124600    
 C   -1.626600     -0.8636000      -2.158800    
 H   -2.099300      -1.199900      0.4264000    
 H   0.1915000       1.660800     -0.4550000    
 H  -0.1461000      -2.417600      0.8698000    
 H    2.315800      -2.591900      0.9704000    
 H    3.727800     -0.6626000      0.3659000    
 H   -3.926000      1.3200000E-02   1.353900    
 H   -3.770000       1.359000      0.1760000    
 H   -3.631900       1.672100       1.915500    
 H  -0.5543000     -0.8050000      -2.364400    
 H   -2.152400     -0.6350000      -3.090400    
 H   -1.904800      -1.876600      -1.851000    


%chk=000105395-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000105395

0 1
Br 3.250136 2.322105 -0.059265
O -1.983226 0.880280 0.950129
O -2.002997 0.071154 -1.247083
C -1.560630 -0.220907 0.138810
C -0.050662 -0.333698 0.239398
C 0.742558 0.830986 0.085178
C 0.565634 -1.588706 0.442886
C 2.141059 0.709323 0.143177
C 1.975169 -1.687573 0.495082
C 2.778515 -0.534861 0.345250
C -3.445063 1.051111 1.000773
C -1.875460 -1.079105 -2.145048
H -2.053450 -1.175955 0.456244
H 0.253339 1.796597 -0.064637
H -0.050930 -2.486833 0.569877
H 2.455248 -2.658662 0.655809
H 3.869404 -0.602539 0.386816
H -3.934997 0.132842 1.386957
H -3.844661 1.292496 0.001304
H -3.618645 1.884527 1.697836
H -0.814638 -1.355821 -2.307153
H -2.321972 -0.766751 -3.101661
H -2.423330 -1.963610 -1.753478


