%chk=000052308.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052308

0 1
 Br  -3.170200       3.015800     -1.3000000E-03
 Br  -4.532700      -2.563000     -1.7000000E-03
 O   -4.949600      0.4946000      2.0000001E-03
 O    5.418300     -0.8922000     -5.0000002E-04
 O    5.084700       1.277500     -3.9999999E-04
 N    4.651200      0.1004000       0.000000    
 C  -0.1148000       1.731300       0.000000    
 C    1.018800      0.7271000       0.000000    
 C   -1.328900      0.8262000     -9.9999997E-05
 C   0.5114000     -0.5917000     -1.9999999E-04
 C  -0.9344000     -0.5307000     -1.9999999E-04
 C    2.379700      0.9782000      1.9999999E-04
 C   -2.663700       1.191000      9.9999997E-05
 C    1.372100      -1.676500      1.9999999E-04
 C   -1.883400      -1.539200       0.000000    
 C    3.247000     -0.1157000      6.0000003E-04
 C   -3.620200      0.1741000      3.9999999E-04
 C    2.748400      -1.429700      6.0000003E-04
 C   -3.233900      -1.177400      3.9999999E-04
 H  -8.0899999E-02   2.343200      0.9061000    
 H  -8.0799997E-02   2.343400     -0.9061000    
 H    2.730300       2.005200      9.9999997E-05
 H    1.001900      -2.696300      1.9999999E-04
 H   -1.581500      -2.582300     -1.9999999E-04
 H    3.413000      -2.291000      7.9999998E-04
 H   -5.033000       1.463800      2.0000001E-03


%chk=000052308-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052308

0 1
Br -3.263943 3.064764 0.000228
Br -4.632201 -2.580881 0.000181
O -5.049057 0.442952 0.000248
O 5.514022 -0.954975 -0.000469
O 5.169324 1.300973 -0.000334
N 4.739465 0.080530 0.000094
C -0.103149 1.757324 0.000176
C 1.041531 0.752797 0.000153
C -1.329191 0.860994 0.000188
C 0.524959 -0.582817 0.000147
C -0.942641 -0.514811 0.000160
C 2.420583 0.987993 0.000140
C -2.687649 1.185381 0.000215
C 1.399642 -1.694261 0.000118
C -1.912552 -1.541321 0.000154
C 3.277213 -0.140918 0.000120
C -3.691167 0.173223 0.000216
C 2.789614 -1.470177 0.000096
C -3.273459 -1.189160 0.000175
H -0.079108 2.420751 0.886505
H -0.079130 2.420762 -0.886146
H 2.854359 1.991435 0.000150
H 1.012391 -2.718066 0.000107
H -1.625375 -2.596155 0.000132
H 3.506428 -2.295179 0.000067
H -5.212109 1.424942 0.000178


