%chk=000035304.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035304

0 1
 Br  -2.429400      -2.777600      0.9645000    
 N    2.151500      0.3977000      0.1114000    
 N   0.1374000     -0.7348000     -0.2883000    
 N   0.1509000       1.619300      0.1758000    
 N   -1.926400      0.4879000     -0.2275000    
 N   -1.882100       2.787400      0.2303000    
 C    2.943100     -0.7969000     -5.2600000E-02
 C   0.7702000      0.4286000     -4.4999998E-03
 C    4.415500     -0.4751000      0.1177000    
 C   -1.197800     -0.6292000     -0.3838000    
 C   -1.185200       1.572700      5.0099999E-02
 C   -1.947900      -1.880000     -0.6930000    
 H    2.650700      -1.548500      0.6895000    
 H    2.782600      -1.223300      -1.049400    
 H    2.610000       1.275900      0.3263000    
 H    4.745100      0.2621000     -0.6222000    
 H    4.615600     -6.2899999E-02   1.112500    
 H    5.020900      -1.378200     -6.3000000E-03
 H   -1.344200      -2.582300      -1.274500    
 H   -2.878600      -1.673800      -1.228400    
 H   -1.365600       3.630100      0.4412000    
 H   -2.889100       2.800000      0.1454000    


%chk=000035304-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035304

0 1
Br -2.475234 -2.867376 1.004280
N 2.149491 0.416657 0.093001
N 0.142088 -0.744735 -0.317581
N 0.169187 1.656158 0.179913
N -1.948743 0.502100 -0.243734
N -1.879467 2.796937 0.226259
C 2.965906 -0.801244 -0.063541
C 0.789047 0.442145 -0.018593
C 4.453731 -0.470866 0.133995
C -1.216435 -0.636867 -0.402081
C -1.191286 1.626093 0.050389
C -1.977138 -1.892545 -0.717406
H 2.631283 -1.561773 0.666800
H 2.789293 -1.232745 -1.066552
H 2.598785 1.305313 0.320611
H 4.804267 0.267192 -0.610813
H 4.644989 -0.067755 1.145565
H 5.061584 -1.384112 0.015427
H -1.361028 -2.611086 -1.272219
H -2.938254 -1.673773 -1.198860
H -1.371099 3.647438 0.453816
H -2.893766 2.783944 0.155525


