%chk=000080577.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080577

0 1
 Br   2.950300     -0.1434000       0.000000    
 O   0.8694000      -2.355700      9.9999997E-05
 N  -0.9483000       1.170400       0.000000    
 N   -1.093200      -1.180500       0.000000    
 N    1.095400       2.401800      9.9999997E-05
 N   -3.017300      0.1700000       0.000000    
 C   0.4318000       1.200900       0.000000    
 C   -1.657800     -3.5999999E-03   0.000000    
 C    1.081800      1.3800000E-02   0.000000    
 C   0.2879000      -1.273600     -9.9999997E-05
 H   -1.419800       2.068200       0.000000    
 H    2.107400       2.423300      6.0000003E-04
 H   0.5608000       3.261000      6.0000003E-04
 H   -3.432900       1.095000      9.9999997E-05
 H   -3.647900     -0.6244000     -9.9999997E-05


%chk=000080577-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080577

0 1
Br 3.016110 -0.114927 0.000199
O 0.836791 -2.449537 -0.000087
N -0.953694 1.249559 0.000074
N -1.119164 -1.149825 -0.000054
N 1.111321 2.420418 0.000209
N -3.058093 0.159479 -0.000024
C 0.452267 1.206382 0.000141
C -1.679325 0.043548 0.000003
C 1.065199 -0.041065 0.000087
C 0.306432 -1.304248 -0.000075
H -1.430518 2.152591 -0.000037
H 2.129910 2.408905 0.000228
H 0.625254 3.312586 0.000624
H -3.557004 1.044287 0.000108
H -3.577885 -0.714953 -0.000096


