%chk=000178497.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178497

0 1
 Br  0.8113000     -0.9076000       2.998500    
 Br   3.567100       2.746100     -0.3901000    
 O   6.9899999E-02  -2.555600      0.6746000    
 N    1.987800      0.3062000     -0.6427000    
 N    2.245100       1.027100       1.442100    
 N   -1.470800      0.8152000     -0.7466000    
 N   -3.674700     -0.3831000      0.5075000    
 C   0.6033000      -1.757700     -0.3914000    
 C  -0.5668000      -1.359400      -1.330400    
 C    1.344700     -0.5432000      0.1666000    
 C    1.579300      -2.678100      -1.148000    
 C   -1.639600     -0.5088000     -0.6836000    
 C    1.492000     -0.1203000       1.429100    
 C    2.527700       1.256300      0.1790000    
 C    2.100300      0.2499000      -2.082400    
 C   -2.704100      -1.111700     -7.8500003E-02
 C   -2.441600       1.543700     -0.1609000    
 C   -3.524200      0.9552000      0.4551000    
 C   -2.306700       3.025900     -0.1981000    
 H   -1.054100      -2.280400      -1.684300    
 H  -0.2758000     -0.8486000      -2.247100    
 H    2.007400      -2.295500      -2.071700    
 H    2.415900      -2.957600     -0.4944000    
 H    1.081500      -3.621900      -1.406000    
 H  -0.4075000      -3.307600      0.2842000    
 H    1.520100     -0.5055000      -2.582400    
 H    1.783900       1.220600      -2.477100    
 H    3.156300      9.0800002E-02  -2.322300    
 H   -2.831600      -2.186000     -3.1500001E-02
 H   -4.308400       1.534000      0.9289000    
 H   -2.263200       3.430100      0.8182000    
 H   -1.390700       3.323700     -0.7189000    
 H   -3.155700       3.473000     -0.7247000    


%chk=000178497-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178497

0 1
Br 1.458608 -1.961296 3.070733
Br 3.384754 2.694901 0.317991
O -0.203575 -2.821915 0.463081
N 1.823567 0.307798 -0.371920
N 2.438013 0.416805 1.815971
N -1.502398 0.807885 -1.113494
N -3.482528 -0.106341 0.708952
C 0.527797 -1.965050 -0.489333
C -0.620090 -1.473766 -1.429992
C 1.274889 -0.848861 0.252335
C 1.532163 -2.844919 -1.281203
C -1.599562 -0.517589 -0.781365
C 1.701234 -0.731922 1.587419
C 2.490579 1.018139 0.625461
C 1.690592 0.724731 -1.780045
C -2.593479 -0.964205 0.131756
C -2.385579 1.685863 -0.536409
C -3.370093 1.211890 0.369009
C -2.256943 3.145183 -0.901226
H -1.144826 -2.397798 -1.733403
H -0.207564 -1.007028 -2.336951
H 2.075676 -2.271048 -2.053848
H 2.279739 -3.279748 -0.594277
H 0.986541 -3.669193 -1.772468
H 0.364200 -3.041224 1.249780
H 1.987143 -0.095604 -2.453806
H 0.647771 1.029919 -1.978031
H 2.366291 1.575696 -1.954055
H -2.659814 -2.018531 0.408646
H -4.085325 1.898729 0.833780
H -1.270950 3.535559 -0.588899
H -2.328625 3.279680 -1.995245
H -3.040106 3.752460 -0.418244


