%chk=000082549.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082549

0 1
 Br   4.732200      -1.464400     -9.6799999E-02
 O   -1.677900      0.3256000     -0.1798000    
 O    1.071300      0.2372000      0.3340000    
 O    3.028700      0.9466000     -0.6518000    
 C   -3.029200      0.2399000      0.2510000    
 C   -3.687500     -0.9506000     -0.4293000    
 C   -1.006200       1.423400      0.4237000    
 C   0.4325000       1.447000     -5.5399999E-02
 C   -5.144000      -1.096800     -2.6799999E-02
 C    2.388500      0.1099000     -3.1099999E-02
 C    2.891500      -1.217900      0.4621000    
 H   -3.557300       1.163500     -1.3800000E-02
 H   -3.061000      0.1146000       1.339700    
 H   -3.611800     -0.8405000      -1.517800    
 H   -3.138200      -1.866400     -0.1804000    
 H   -1.505400       2.360100      0.1526000    
 H   -1.030500       1.300500       1.512800    
 H   0.9575000       2.301900      0.3848000    
 H   0.4568000       1.522200      -1.148700    
 H   -5.718800     -0.2071000     -0.3030000    
 H   -5.591700      -1.959700     -0.5297000    
 H   -5.239300      -1.246200       1.053400    
 H    2.314900      -2.035200      2.4300000E-02
 H    2.879600      -1.252800       1.553100    


%chk=000082549-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000082549

0 1
Br 4.423386 -0.672249 1.380000
O -1.649759 0.495195 -0.211243
O 1.248761 0.442003 0.483927
O 2.336711 0.095550 -1.561751
C -2.996893 0.272943 0.332874
C -3.650113 -0.848963 -0.479907
C -0.921783 1.547512 0.493275
C 0.488572 1.597690 -0.071050
C -5.073991 -1.173240 0.022420
C 2.133927 -0.211175 -0.366696
C 2.806038 -1.356204 0.366230
H -3.596090 1.209880 0.261452
H -2.928127 -0.008816 1.408571
H -3.677120 -0.546215 -1.543390
H -3.007452 -1.747186 -0.419574
H -1.410642 2.536424 0.336268
H -0.890015 1.345841 1.586491
H 1.015551 2.513102 0.252712
H 0.485328 1.534829 -1.172607
H -5.739158 -0.292281 -0.053056
H -5.525171 -1.985718 -0.574313
H -5.063443 -1.498987 1.079758
H 3.196477 -2.092235 -0.347675
H 2.149704 -1.802901 1.124382


