%chk=000137714.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137714

0 1
 Br   3.798600      0.4598000      0.1137000    
 S   -3.675700      0.2785000     -0.1588000    
 N  -0.9525000      0.2543000      0.3339000    
 C    1.247400     -0.8024000      0.1792000    
 C  -0.2234000     -0.8918000     -0.2115000    
 C    1.913200      0.4476000     -0.3753000    
 C   -2.107600      0.2540000      0.1187000    
 H    1.765000      -1.697200     -0.1879000    
 H    1.335400     -0.8142000       1.273200    
 H  -0.3089000     -0.9209000      -1.306200    
 H  -0.6330000      -1.832100      0.1813000    
 H    1.874800      0.4809000      -1.467500    
 H    1.486500       1.366700      3.4499999E-02


%chk=000137714-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137714

0 1
Br 3.621020 0.914112 0.342412
S -3.474819 1.295655 0.379112
N -1.132897 -0.254771 -0.043624
C 1.268869 -0.840756 0.200277
C -0.126100 -1.221484 -0.367005
C 1.773013 0.484858 -0.376769
C -2.144388 0.383503 0.126031
H 1.969284 -1.657054 -0.054215
H 1.214215 -0.778226 1.301237
H -0.067865 -1.329017 -1.469528
H -0.420035 -2.207966 0.043341
H 1.893418 0.454825 -1.471060
H 1.146086 1.339522 -0.082909


