%chk=000101332.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101332

0 1
 Br   7.047800      0.6429000      -1.024400    
 S    1.017600     -0.5340000      0.8555000    
 O   8.8900000E-02  0.1814000     -0.2901000    
 O   0.8579000      -1.972800      0.7698000    
 O   0.8262000      0.1828000       2.102500    
 O   -6.072700     -0.9860000     -0.2247000    
 O   -6.094400       1.212000     -0.1458000    
 N   -5.480800      0.1192000     -0.1956000    
 C    2.675800     -0.2098000      0.3377000    
 C   -1.272000      0.1664000     -0.2670000    
 C    3.309600      0.9385000      0.7796000    
 C    3.310600      -1.111000     -0.4995000    
 C   -1.956200      -1.048800     -0.2973000    
 C   -1.982400       1.365600     -0.2125000    
 C   -4.061100      0.1343000     -0.2191000    
 C    4.618800       1.193800      0.3717000    
 C    4.620000     -0.8559000     -0.9073000    
 C   -3.350800      -1.064800     -0.2734000    
 C   -3.377000       1.349500     -0.1885000    
 C    5.274200      0.2966000     -0.4717000    
 H    2.814700       1.653600       1.429500    
 H    2.817100      -2.009000     -0.8578000    
 H   -1.424900      -1.993000     -0.3623000    
 H   -1.454100       2.314800     -0.1879000    
 H    5.113700       2.097300      0.7185000    
 H    5.115600      -1.564000      -1.566500    
 H   -3.850100      -2.029900     -0.3035000    
 H   -3.896400       2.303400     -0.1460000    


%chk=000101332-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101332

0 1
Br 7.079591 0.484062 -1.357839
S 1.085480 -0.429557 1.189497
O 0.082290 0.335657 -0.379293
O 0.741929 -2.013557 1.265070
O 0.873469 0.536651 2.473774
O -6.120997 -1.094312 -0.612590
O -6.224110 1.100277 0.005164
N -5.568083 0.030559 -0.301032
C 2.784751 -0.168091 0.458397
C -1.298412 0.233763 -0.303982
C 3.437812 1.044790 0.731477
C 3.331972 -1.197361 -0.324693
C -1.945857 -0.993291 -0.630273
C -2.059264 1.384328 0.051157
C -4.085828 0.099000 -0.295763
C 4.727466 1.234816 0.188139
C 4.622199 -0.999667 -0.863792
C -3.348632 -1.062141 -0.627791
C -3.462404 1.323003 0.043524
C 5.298896 0.213787 -0.604495
H 2.968759 1.809544 1.357786
H 2.783789 -2.128514 -0.496673
H -1.335735 -1.865323 -0.882190
H -1.530725 2.305362 0.313269
H 5.272656 2.162678 0.379304
H 5.087046 -1.777672 -1.474859
H -3.882008 -1.983168 -0.875949
H -4.080452 2.187479 0.298558


