%chk=000177849.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177849

0 1
 Br  -4.580900     -0.4530000      0.3618000    
 S    2.290300       1.091900       1.042300    
 O    2.110200     -0.6675000     -0.9406000    
 C    1.469900      0.5335000     -0.4777000    
 C    3.460000     -0.2743000      0.9943000    
 C    3.464600     -0.6591000     -0.4736000    
 C  -5.1000002E-03  0.2942000     -0.2736000    
 C  -0.9126000       1.339600     -0.4435000    
 C  -0.4615000     -0.9741000      8.5600004E-02
 C   -2.276500       1.116900     -0.2543000    
 C   -1.825400      -1.196800      0.2747000    
 C   -2.733000     -0.1513000      0.1048000    
 H    1.618700       1.292300      -1.254800    
 H    3.067000      -1.088100       1.610900    
 H    4.450600      1.1200000E-02   1.356200    
 H    4.045200      4.7100000E-02  -1.080500    
 H    3.893100      -1.655200     -0.6199000    
 H  -0.5695000       2.332300     -0.7227000    
 H   0.2251000      -1.802800      0.2353000    
 H   -2.970500       1.942400     -0.3904000    
 H   -2.164600      -2.190300      0.5569000    


%chk=000177849-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177849

0 1
Br -4.756106 -0.389056 0.258394
S 2.292368 0.945870 1.340412
O 2.095417 -0.725300 -0.828600
C 1.433583 0.481626 -0.386218
C 3.664814 -0.310477 0.983083
C 3.532171 -0.630462 -0.521324
C -0.045867 0.258349 -0.246761
C -0.946274 1.318381 -0.509420
C -0.555465 -0.998088 0.163254
C -2.339855 1.139721 -0.357065
C -1.944118 -1.196975 0.309082
C -2.820098 -0.120672 0.050791
H 1.671213 1.337386 -1.046182
H 3.505334 -1.202857 1.607155
H 4.638544 0.150254 1.214299
H 4.000045 0.171275 -1.128839
H 3.963491 -1.607745 -0.789863
H -0.566576 2.294298 -0.835011
H 0.141589 -1.819136 0.353574
H -3.031984 1.961904 -0.558509
H -2.337126 -2.169395 0.618948


