%chk=000090376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090376

0 1
 Br   2.962000       1.346700      -1.177100    
 Br   3.774100     -0.6061000       1.164800    
 S   0.1978000       2.126500      0.2168000    
 O    1.550600      -1.790200      -1.280300    
 O   -3.117000      -1.174400     -0.5707000    
 O   -1.625800      -2.191000      0.8217000    
 N   0.2990000     -0.4654000      0.2193000    
 C   0.9985000      0.6290000      0.8989000    
 C   -1.417400       1.220000      1.9700000E-02
 C  -0.9880000     -0.2044000     -0.3930000    
 C    2.281800      0.1538000      0.2040000    
 C    1.400000     -0.9378000     -0.4346000    
 C   -2.168200       1.296900       1.356000    
 C   -2.236300       1.896600      -1.081200    
 C   -1.911200      -1.300000      3.5599999E-02
 H   0.9684000      0.5339000       1.988300    
 H  -0.8517000     -0.2876000      -1.479600    
 H   -1.630000      0.7885000       2.164000    
 H   -2.331000       2.336600       1.664400    
 H   -3.158200      0.8334000       1.282100    
 H   -2.461800       2.939800     -0.8304000    
 H   -1.709600       1.890800      -2.042600    
 H   -3.194400       1.387600      -1.231200    
 H   -3.738200      -1.884300     -0.3014000    


%chk=000090376-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090376

0 1
Br 3.415804 1.340858 -1.019787
Br 3.585696 -0.732787 1.531253
S 0.229804 2.234722 0.118517
O 1.647516 -1.749832 -1.518208
O -3.124273 -1.328956 -0.698392
O -1.855372 -1.987041 1.140896
N 0.347881 -0.437475 0.065620
C 1.046474 0.662923 0.785288
C -1.454083 1.242263 0.010937
C -1.017595 -0.228632 -0.416701
C 2.389738 0.118517 0.162514
C 1.488160 -0.908349 -0.627446
C -2.128843 1.281459 1.398352
C -2.322802 1.902638 -1.072531
C -1.991126 -1.280719 0.127261
H 1.000009 0.629312 1.881913
H -1.030230 -0.302888 -1.520288
H -1.522377 0.780128 2.172222
H -2.283870 2.328599 1.705915
H -3.118339 0.785681 1.365116
H -2.609030 2.925731 -0.772207
H -1.790010 1.958896 -2.037431
H -3.247745 1.314817 -1.216755
H -3.761986 -2.010963 -0.352555


