%chk=000096042.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096042

0 1
 Br  -3.107000      -1.090000      0.1412000    
 S    1.390700      1.2100000E-02  0.1052000    
 O  -0.1800000     -2.4900001E-02 -0.3427000    
 O    1.506200     -0.4024000       1.488700    
 O    2.002500       1.230300     -0.3853000    
 C   -1.076600      0.9112000      0.2355000    
 C    1.931900      -1.330700     -0.9212000    
 C   -2.467600      0.6945000     -0.3215000    
 H  -0.7398000       1.925300     -4.9999999E-03
 H   -1.071000      0.7924000       1.325000    
 H    3.002600      -1.471600     -0.7597000    
 H    1.389300      -2.234300     -0.6367000    
 H    1.742100      -1.076300      -1.965700    
 H   -3.187600       1.407000      8.7899998E-02
 H   -2.477700      0.7340000      -1.414100    


%chk=000096042-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096042

0 1
Br -2.287814 -1.526200 -0.084367
S 1.564906 0.147126 0.114204
O 0.030563 0.870917 -0.760546
O 1.159334 -0.148096 1.657313
O 2.828084 1.080206 -0.246260
C -1.081061 1.175079 0.150965
C 1.643804 -1.463733 -0.881891
C -2.352114 0.488129 -0.336296
H -1.238641 2.273279 0.131071
H -0.826523 0.871942 1.187794
H 2.522813 -2.010664 -0.512857
H 0.694210 -1.978703 -0.684154
H 1.744327 -1.155731 -1.931053
H -3.229756 0.819612 0.241976
H -2.514132 0.633437 -1.414300


