%chk=000065754.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065754

0 1
 Br   3.602200      0.8187000     -0.7347000    
 S   0.6022000       2.065200      0.2134000    
 O    1.762000      -2.051100     -0.8462000    
 O   -2.882300      -1.005900     -0.7521000    
 O   -1.659100      -2.031200      0.8753000    
 N   0.4694000     -0.5186000      0.3991000    
 C    1.181000      0.5639000       1.085200    
 C   -1.054300       1.280500     -0.1187000    
 C  -0.7095000     -0.2013000     -0.3811000    
 C    2.488200     -6.5499999E-02  0.5845000    
 C    1.591800      -1.127300     -8.3300002E-02
 C   -1.944500       1.519700       1.108400    
 C   -1.676300       1.935500      -1.353200    
 C   -1.770700      -1.182500      3.3000000E-03
 H    1.026800      0.5526000       2.168000    
 H  -0.4567000     -0.3779000      -1.435300    
 H    3.100700     -0.4887000       1.389000    
 H   -1.551100       1.032500       2.007600    
 H   -2.048000       2.589700       1.325400    
 H   -2.956900       1.133800      0.9455000    
 H   -1.834900       3.009700      -1.201100    
 H   -1.044800       1.813700      -2.241000    
 H   -2.652500       1.496100      -1.584900    
 H   -3.591600      -1.640300     -0.5143000    


%chk=000065754-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065754

0 1
Br 3.956703 0.930936 -0.309133
S 0.666665 2.121362 0.149085
O 1.916508 -1.926055 -1.174404
O -2.920877 -1.175992 -0.821865
O -1.939337 -1.757410 1.207553
N 0.523060 -0.542598 0.262885
C 1.220238 0.532435 1.021950
C -1.080231 1.293807 -0.134849
C -0.754463 -0.249340 -0.385519
C 2.575723 -0.148789 0.630696
C 1.713497 -1.082178 -0.290874
C -1.939681 1.524549 1.126473
C -1.711783 1.934466 -1.383051
C -1.885823 -1.146569 0.125347
H 0.997328 0.586499 2.096959
H -0.653059 -0.423782 -1.472862
H 3.093970 -0.649413 1.461803
H -1.504784 1.047198 2.021428
H -2.027036 2.606101 1.321435
H -2.960337 1.119947 0.982804
H -1.923589 3.003952 -1.208537
H -1.046077 1.850075 -2.259270
H -2.666200 1.428554 -1.617813
H -3.659314 -1.756456 -0.491439


