%chk=000177936.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177936

0 1
 Br  -1.490900      -3.559200     -0.3020000    
 O    2.215200      0.8871000       2.114900    
 O    4.163500     -0.4983000      -1.573100    
 O   -3.051000       2.680100      0.2033000    
 N    2.804500     -0.5510000      0.3537000    
 N   -1.679500     -0.6309000     -0.1589000    
 N    2.490300       1.082700      -1.169900    
 N  -0.8952000       2.036200     -0.2354000    
 C    1.750600      0.2809000      0.9225000    
 C    1.472900       1.336300     -0.1717000    
 C   6.5700002E-02   1.037500     -0.7167000    
 C  -0.2585000     -0.3817000     -0.2178000    
 C   0.4241000     -0.4406000       1.148800    
 C    3.261600     -5.0500002E-02 -0.8769000    
 C   -2.603100      0.3814000     -6.4999998E-02
 C   -2.243600       1.780000     -1.9900000E-02
 C    3.366600      -1.697800       1.040600    
 C   -2.295400      -1.848300     -0.1828000    
 C   -3.846300     -0.2206000     -7.0000002E-03
 C   -3.651400      -1.623500     -8.6700000E-02
 H    1.592900       2.368400      0.1742000    
 H   1.9600000E-02   1.087400      -1.811300    
 H   0.1930000      -1.110900     -0.9018000    
 H  -0.1689000      8.1900001E-02   1.911200    
 H   0.5447000      -1.468900       1.503000    
 H    2.624400       1.651900      -1.999600    
 H  -0.6053000       3.009600     -0.2375000    
 H    3.081300       1.281500       1.916200    
 H    3.746400      -1.379900       2.014900    
 H    4.186000      -2.123800      0.4558000    
 H    2.590900      -2.455300       1.172900    
 H   -4.793500      0.2943000      7.8800000E-02
 H   -4.423700      -2.380600     -7.1699999E-02


%chk=000177936-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000177936

0 1
Br -1.391305 -3.539867 -0.390025
O 2.191473 0.950863 2.171746
O 4.271173 -0.570738 -1.537551
O -3.082740 2.722118 0.269385
N 2.814804 -0.535031 0.351031
N -1.685108 -0.647308 -0.203410
N 2.551964 1.048199 -1.227976
N -0.905334 2.028767 -0.203457
C 1.771702 0.326223 0.917679
C 1.497079 1.354489 -0.266740
C 0.046355 1.054803 -0.769977
C -0.245538 -0.370935 -0.212189
C 0.428541 -0.377891 1.182925
C 3.320464 -0.072207 -0.881723
C -2.654495 0.365028 -0.046702
C -2.268779 1.781964 0.015787
C 3.338649 -1.730411 1.011965
C -2.343226 -1.872461 -0.205826
C -3.916123 -0.247054 0.030164
C -3.724288 -1.662338 -0.071206
H 1.563060 2.388713 0.120788
H 0.014344 1.058717 -1.878702
H 0.250999 -1.109604 -0.866533
H -0.156364 0.223142 1.899122
H 0.555106 -1.392366 1.591654
H 2.770439 1.596955 -2.055643
H -0.641084 3.017964 -0.187211
H 3.097494 1.338047 2.045918
H 3.593745 -1.516046 2.064585
H 4.249076 -2.035700 0.469640
H 2.616923 -2.569135 0.982710
H -4.856700 0.288097 0.141218
H -4.484409 -2.439595 -0.056348


