%chk=000021650.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021650

0 1
 Br   5.310500     -6.0000003E-04 -0.8157000    
 N  -0.4945000      1.4000000E-03  0.9869000    
 N   -1.251200      6.9999998E-04 -9.7000003E-03
 N   -3.721800       2.202400     -0.5836000    
 N   -3.718800      -2.204200     -0.5832000    
 C   0.8415000      8.9999998E-04  0.5726000    
 C    1.507700       1.208600      0.3651000    
 C    1.507200      -1.207400      0.3664000    
 C    2.839700       1.208000     -4.8799999E-02
 C    2.839300      -1.208100     -4.7499999E-02
 C    3.505600     -3.0000001E-04 -0.2551000    
 C   -2.661900     -1.9999999E-04  0.3756000    
 C   -3.252500       1.228400     -0.1615000    
 C   -3.250900      -1.229600     -0.1614000    
 H   0.9976000       2.155300      0.5237000    
 H   0.9966000      -2.153600      0.5261000    
 H    3.344500       2.157800     -0.2060000    
 H    3.343600      -2.158300     -0.2036000    
 H   -2.784100     -1.9999999E-04   1.467300    


%chk=000021650-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021650

0 1
Br 5.557142 -0.266468 -0.394059
N -0.509307 0.497580 0.537413
N -1.340666 -0.317818 -0.036029
N -4.082399 0.733400 -1.887826
N -3.880390 -1.978873 1.649894
C 0.875855 0.245314 0.265421
C 1.779676 1.142683 0.889028
C 1.362792 -0.809170 -0.558147
C 3.168774 0.999071 0.698836
C 2.746259 -0.957935 -0.751250
C 3.635416 -0.051933 -0.120577
C -2.778340 0.074063 0.346508
C -3.515276 0.423790 -0.886951
C -3.404189 -1.063990 1.053683
H 1.377073 1.943755 1.516621
H 0.652900 -1.493523 -1.032308
H 3.870754 1.687547 1.176195
H 3.135972 -1.762950 -1.380412
H -2.753948 0.956457 1.021560


