%chk=000052694.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052694

0 1
 Br   4.027000     -0.4919000     -0.3841000    
 O    1.712400       1.289700      0.8529000    
 C    1.316700     -3.2000002E-02  0.4609000    
 C  -0.1534000     -4.2700000E-02  0.2099000    
 C    2.114100     -0.4498000     -0.7788000    
 C  -0.7886000       1.105600     -0.2630000    
 C  -0.8933000      -1.201200      0.4478000    
 C   -2.163500       1.095800     -0.4980000    
 C   -2.268200      -1.211000      0.2126000    
 C   -2.903200     -6.2500000E-02 -0.2602000    
 H    1.550700     -0.6866000       1.309600    
 H    1.845400      -1.450200      -1.130000    
 H    2.005200      0.2684000      -1.597400    
 H  -0.2356000       2.017500     -0.4707000    
 H  -0.4098000      -2.102800      0.8143000    
 H   -2.657600       1.988700     -0.8695000    
 H   -2.844400      -2.113100      0.3969000    
 H   -3.973600     -7.0600003E-02 -0.4443000    
 H    2.674100       1.273100      0.9965000    


%chk=000052694-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052694

0 1
Br 4.091024 -0.601447 -0.452057
O 1.759784 1.383432 0.812210
C 1.356319 0.010679 0.512293
C -0.148379 -0.002208 0.253166
C 2.067396 -0.516942 -0.749481
C -0.813775 1.162416 -0.200532
C -0.880076 -1.204081 0.422954
C -2.198394 1.122545 -0.479066
C -2.263422 -1.243595 0.140050
C -2.926006 -0.079196 -0.314280
H 1.598044 -0.661153 1.363170
H 1.777488 -1.547453 -1.001583
H 1.934972 0.161146 -1.606070
H -0.242940 2.090129 -0.300312
H -0.373915 -2.106194 0.790566
H -2.710493 2.029302 -0.820102
H -2.823304 -2.174868 0.280286
H -4.000008 -0.106941 -0.529861
H 2.750084 1.408829 0.884048


