%chk=000006972.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006972

0 1
 Br  -3.453300       1.432200      0.1295000    
 O    1.504100      -2.013100     -0.1278000    
 O    1.796300       2.050000     -0.5043000    
 O    2.845600      0.3092000      0.5130000    
 C   0.5093000      0.1651000      1.7999999E-02
 C   0.3956000      -1.222400     -6.8999998E-02
 C  -0.6378000      0.9566000      7.7200003E-02
 C  -0.8653000      -1.818400     -9.6699998E-02
 C   -1.898500      0.3606000      4.9400002E-02
 C   -2.012300      -1.026900     -3.7500001E-02
 C    1.816300      0.8070000      4.8300002E-02
 H  -0.5646000       2.038800      0.1585000    
 H  -0.9609000      -2.898700     -0.1643000    
 H   -2.987200      -1.507100     -6.0199998E-02
 H    2.309700      -1.472600     -0.1491000    
 H    2.680300       2.474700     -0.4799000    


%chk=000006972-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000006972

0 1
Br -3.574439 1.435005 0.032596
O 1.511463 -2.045928 -0.073499
O 1.848790 2.197748 -0.084184
O 2.916061 0.143129 -0.115662
C 0.495901 0.204691 -0.055214
C 0.403434 -1.229822 -0.049972
C -0.689359 0.994029 -0.030194
C -0.875105 -1.843605 -0.017032
C -1.934329 0.358848 0.000234
C -2.037859 -1.057076 0.007566
C 1.828779 0.811165 -0.087290
H -0.600571 2.082887 -0.035476
H -0.929757 -2.935271 -0.012450
H -3.021032 -1.535704 0.031619
H 2.343646 -1.458844 -0.097329
H 2.791678 2.513749 -0.108612


