%chk=000034164.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034164

0 1
 Br   5.952900     -0.2031000      -1.103700    
 S   6.3000000E-03 -7.6300003E-02   1.420600    
 O  -0.4502000       1.442800     -0.6765000    
 C   -2.351600      0.2204000     -2.1900000E-02
 C    1.647500     -0.1106000      0.7237000    
 C   -3.293000       1.123400     -0.5159000    
 C   -2.747900      -1.061500      0.3593000    
 C  -0.9562000      0.6138000      9.4800003E-02
 C    1.897700     -0.8481000     -0.4329000    
 C    2.679200      0.5999000       1.335900    
 C   -4.630600      0.7444000     -0.6290000    
 C   -4.085600      -1.440400      0.2463000    
 C    3.181400     -0.8752000     -0.9779000    
 C    3.962900      0.5728000      0.7910000    
 C   -5.026900     -0.5375000     -0.2479000    
 C    4.214000     -0.1648000     -0.3659000    
 H   -3.003400       2.127600     -0.8144000    
 H   -2.045000      -1.805300      0.7225000    
 H    1.107700      -1.411600     -0.9236000    
 H    2.502200       1.180600       2.237900    
 H   -5.363800       1.447500      -1.013300    
 H   -4.393700      -2.440600      0.5368000    
 H    3.360400      -1.455500      -1.879300    
 H    4.756500       1.131800       1.280200    
 H   -6.068200     -0.8330000     -0.3373000    


%chk=000034164-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034164

0 1
Br 6.286974 0.707673 -0.556737
S 0.055891 -1.011651 0.792798
O -0.456649 0.823316 -1.214267
C -2.456479 -0.040219 -0.143597
C 1.761994 -0.480045 0.365039
C -3.306235 0.646998 -1.055050
C -3.029678 -0.801974 0.909231
C -0.984054 0.087804 -0.353234
C 2.238729 -0.512588 -0.964964
C 2.617377 -0.093076 1.422115
C -4.705761 0.567528 -0.916141
C -4.431171 -0.878991 1.043429
C 3.576887 -0.152760 -1.241865
C 3.961288 0.254658 1.155277
C -5.271917 -0.196532 0.132495
C 4.422012 0.221794 -0.176839
H -2.848558 1.233284 -1.858428
H -2.388703 -1.325043 1.626790
H 1.578133 -0.805741 -1.784402
H 2.241688 -0.057219 2.449440
H -5.355023 1.097646 -1.621020
H -4.868219 -1.466172 1.857840
H 3.948274 -0.170337 -2.270071
H 4.626225 0.551002 1.970988
H -6.360427 -0.257856 0.240674


