%chk=000019618.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019618

0 1
 Br   5.059700       1.441700     -8.3899997E-02
 Br  -5.060100       1.442600      8.4799998E-02
 O    1.373500     -0.2318000     -0.2891000    
 O   -1.370200     -0.2390000      0.2863000    
 O    3.337200     -0.8827000      0.7243000    
 O   -3.338100     -0.8820000     -0.7239000    
 C   0.7234000      -1.398400      0.2260000    
 C  -0.7243000      -1.398200     -0.2258000    
 C    2.695300     -9.7800002E-02  4.0899999E-02
 C   -2.696000     -9.7300000E-02 -4.0399998E-02
 C    3.205100       1.171300     -0.5825000    
 C   -3.205600       1.171700      0.5833000    
 H    1.230800      -2.295900     -0.1443000    
 H   0.7706000      -1.369700       1.320700    
 H   -1.229500      -2.297800      0.1428000    
 H  -0.7693000      -1.371800      -1.320700    
 H    2.648300       2.034200     -0.2116000    
 H    3.171800       1.105700      -1.671700    
 H   -2.648200       2.034200      0.2126000    
 H   -3.172100       1.105600       1.672500    


%chk=000019618-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019618

0 1
Br 5.122307 1.644048 -0.098906
Br -5.124039 1.640705 0.105067
O 1.430266 -0.290798 -0.370591
O -1.428733 -0.289170 0.367955
O 3.287914 -0.754178 0.965727
O -3.290408 -0.757462 -0.960960
C 0.706578 -1.425026 0.270384
C -0.706280 -1.424257 -0.273072
C 2.734564 -0.066530 0.090092
C -2.734807 -0.067256 -0.088752
C 3.285545 1.128893 -0.679860
C -3.284601 1.129074 0.680646
H 1.224451 -2.366719 0.011246
H 0.730126 -1.298401 1.366351
H -1.225230 -2.365408 -0.014163
H -0.729655 -1.297365 -1.369014
H 2.637197 2.005526 -0.531572
H 3.338840 0.895165 -1.754290
H -2.637892 2.006213 0.528260
H -3.333842 0.897547 1.755752


