%chk=000077158.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077158

0 1
 Br  -3.111000      -2.733500     -0.1018000    
 N   3.9000001E-02   2.382100      0.1037000    
 N    4.196500      -1.724400      0.2996000    
 C    1.234600      0.5661000     -0.3427000    
 C  -0.1236000      0.1750000     -0.1782000    
 C    2.374000     -0.3223000     -0.6508000    
 C  -0.8525000       1.333100      0.1011000    
 C    1.302900       1.928400     -0.1634000    
 C    3.055300     -0.8725000      0.6168000    
 C  -0.8051000      -1.056600     -0.2404000    
 C   -2.234200       1.320900      0.3222000    
 C   -2.187200      -1.084000     -2.1500001E-02
 C   -2.888700      8.7700002E-02  0.2554000    
 H    2.038300      -1.157100      -1.279100    
 H    3.113600      0.2269000      -1.248800    
 H    2.135800       2.616800     -0.2011000    
 H  -0.2049000       3.347300      0.2780000    
 H    2.333300      -1.446500       1.209700    
 H    3.399800     -4.2900000E-02   1.244900    
 H  -0.2579000      -1.970800     -0.4548000    
 H   -2.781100       2.232600      0.5379000    
 H   -3.963100      6.1400000E-02  0.4252000    
 H    3.886000      -2.516600     -0.2614000    
 H    4.576800      -2.114700       1.160800    


%chk=000077158-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077158

0 1
Br -3.029604 -2.836839 0.062213
N -0.017795 2.495808 0.023546
N 4.113926 -1.859561 0.300306
C 1.280893 0.644834 -0.363345
C -0.095917 0.222379 -0.158577
C 2.473220 -0.241058 -0.625425
C -0.887274 1.402654 0.081122
C 1.281698 2.035278 -0.244996
C 2.939514 -1.028865 0.628770
C -0.732079 -1.048709 -0.165823
C -2.278429 1.343010 0.314624
C -2.114696 -1.089293 0.066211
C -2.895398 0.075466 0.306901
H 2.232714 -0.969770 -1.427936
H 3.333059 0.351159 -0.987186
H 2.115003 2.730042 -0.336566
H -0.284687 3.470116 0.142770
H 2.072301 -1.602613 1.036144
H 3.234581 -0.305063 1.410897
H -0.164381 -1.965364 -0.349185
H -2.875400 2.242879 0.497224
H -3.970618 -0.014469 0.484232
H 3.928666 -2.587775 -0.397024
H 4.617304 -2.227847 1.112403


