%chk=000138468.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138468

0 1
 Br  -3.523300       1.137100     -1.9999999E-04
 S   -1.228800     -0.8979000       0.000000    
 O   -1.519600      -1.525900       1.271700    
 O   -1.519600      -1.525900      -1.271700    
 C   0.4604000     -0.4646000       0.000000    
 C   0.5939000      0.9222000      9.9999997E-05
 C   -1.729300      0.7641000       0.000000    
 C  -0.6923000       1.611600      1.9999999E-04
 C    1.525800      -1.340100      9.9999997E-05
 C    1.862600       1.477800       0.000000    
 C    2.801200     -0.7775000     -9.9999997E-05
 C    2.969100      0.6192000     -1.9999999E-04
 H  -0.7650000       2.689400      3.0000001E-04
 H    1.387200      -2.414400      1.9999999E-04
 H    2.007800       2.553400       0.000000    
 H    3.676000      -1.422100     -9.9999997E-05
 H    3.972700       1.036900     -3.0000001E-04


%chk=000138468-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000138468

0 1
Br -3.633977 1.365264 0.000086
S -1.317675 -1.022839 0.000037
O -1.738634 -1.735245 1.400420
O -1.738710 -1.735237 -1.400327
C 0.518468 -0.494716 -0.000008
C 0.605529 0.915096 0.000001
C -1.802395 0.882522 0.000050
C -0.680626 1.645601 0.000033
C 1.612614 -1.355991 -0.000034
C 1.895329 1.493755 -0.000035
C 2.901460 -0.756019 -0.000042
C 3.033700 0.652359 -0.000043
H -0.701980 2.739691 0.000036
H 1.493240 -2.443307 -0.000027
H 2.007436 2.583463 -0.000036
H 3.792476 -1.391445 -0.000052
H 4.032546 1.100349 -0.000060


