%chk=000011454.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011454

0 1
 Br   2.545600      0.9630000       1.206200    
 C    1.727300      0.2085000     -0.4125000    
 C   0.2550000      9.3900003E-02 -0.2031000    
 C  -0.5789000       1.169000     -0.5108000    
 C  -0.2881000      -1.088400      0.3000000    
 C    2.458900      -1.092500     -0.7476000    
 C   -1.955800       1.062000     -0.3153000    
 C   -1.665100      -1.195400      0.4954000    
 C   -2.498900     -0.1202000      0.1877000    
 H    1.940400      0.9362000      -1.204300    
 H  -0.1694000       2.096300     -0.9027000    
 H   0.3289000      -1.941100      0.5637000    
 H    2.001800      -1.588600      -1.610800    
 H    2.475200      -1.801400      8.7499999E-02
 H    3.505000     -0.8857000      -1.003000    
 H   -2.605100       1.899100     -0.5544000    
 H   -2.088300      -2.114500      0.8901000    
 H   -3.570900     -0.2032000      0.3407000    


%chk=000011454-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000011454

0 1
Br 2.663459 0.809889 1.399802
C 1.752804 0.192835 -0.388114
C 0.267469 0.067555 -0.165853
C -0.586570 1.125816 -0.573661
C -0.309501 -1.086440 0.427847
C 2.490161 -1.061584 -0.862837
C -1.985232 1.031549 -0.404504
C -1.706131 -1.180869 0.600896
C -2.549666 -0.123584 0.183525
H 1.980376 1.055912 -1.033633
H -0.150819 2.027350 -1.021941
H 0.334312 -1.904416 0.769295
H 2.060897 -1.391970 -1.828960
H 2.396549 -1.892429 -0.144046
H 3.563239 -0.854531 -1.006536
H -2.631003 1.855506 -0.727342
H -2.138468 -2.074953 1.063592
H -3.634276 -0.198635 0.319270


