%chk=000089930.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089930

0 1
 Br   5.580600       3.701400     -0.3807000    
 Br   4.729800      -4.143000      0.1061000    
 O   -1.715000      0.5604000      0.4403000    
 O   -1.965500      -1.229600      -1.033300    
 N    3.792900     -6.4900003E-02 -4.4999998E-03
 C    4.613800       1.010700     -0.5245000    
 C    4.424100      -1.310300      0.3844000    
 C    2.396000      9.3699999E-02  0.1088000    
 C    1.694400     -0.5904000       1.101300    
 C    1.716100      0.9343000     -0.7727000    
 C    4.486000       2.254800      0.3333000    
 C    3.887700      -2.469400     -0.4332000    
 C   0.3128000     -0.4342000       1.212300    
 C   0.3344000       1.090700     -0.6617000    
 C  -0.3310000      0.4024000      0.3280000    
 C   -3.881700     -0.1254000     -0.1425000    
 C   -2.454900     -0.3513000     -0.3093000    
 C   -4.760700     -0.4181000      -1.185300    
 C   -4.371400      0.3834000       1.060500    
 C   -6.129300     -0.2017000      -1.025300    
 C   -5.740100      0.5996000       1.220400    
 C   -6.619100      0.3070000      0.1775000    
 H    5.669800      0.7119000     -0.5482000    
 H    4.366100       1.217600      -1.572900    
 H    5.510600      -1.253700      0.2381000    
 H    4.303700      -1.488100       1.460000    
 H    2.185800      -1.239700       1.819100    
 H    2.219100       1.470900      -1.570900    
 H    4.838000       2.077500       1.354300    
 H    3.473000       2.659900      0.3802000    
 H    4.104200      -2.344900      -1.498600    
 H    2.815200      -2.637700     -0.3134000    
 H  -0.2335000     -0.9625000       1.987300    
 H  -0.1959000       1.742200      -1.349200    
 H   -4.395600     -0.8125000      -2.130000    
 H   -3.712700      0.6083000       1.895300    
 H   -6.813700     -0.4289000      -1.837400    
 H   -6.122200      0.9929000       2.158000    
 H   -7.684800      0.4748000      0.3024000    


%chk=000089930-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089930

0 1
Br 5.816573 3.710183 0.619159
Br 5.679823 -3.840313 -0.626975
O -1.873545 0.255257 -0.012216
O -2.553004 -1.953037 0.437595
N 3.812038 -0.032428 0.010530
C 4.603123 1.179433 -0.262663
C 4.551561 -1.278559 0.275127
C 2.396091 -0.000629 0.013970
C 1.624916 -1.183719 0.217406
C 1.682485 1.221365 -0.186855
C 4.784366 2.007114 1.025596
C 4.692360 -2.107897 -1.016919
C 0.215616 -1.164394 0.226470
C 0.277992 1.245340 -0.186985
C -0.460211 0.060380 0.020034
C -4.213350 -0.201608 0.092474
C -2.832487 -0.753901 0.196749
C -5.296130 -1.099349 0.289671
C -4.472154 1.165019 -0.192745
C -6.623764 -0.634606 0.202992
C -5.802895 1.624773 -0.278792
C -6.880207 0.728220 -0.081433
H 5.594640 0.887152 -0.651024
H 4.127614 1.793354 -1.047862
H 5.556027 -1.029906 0.660671
H 4.053090 -1.874338 1.059775
H 2.112971 -2.150827 0.369280
H 2.212189 2.165607 -0.339842
H 5.380570 1.477525 1.783983
H 3.826843 2.339046 1.452787
H 5.294740 -1.593644 -1.781069
H 3.720543 -2.410778 -1.433179
H -0.344811 -2.085501 0.387139
H -0.259846 2.185635 -0.341537
H -5.073355 -2.148926 0.508182
H -3.632378 1.848131 -0.343636
H -7.456515 -1.329334 0.355984
H -6.001863 2.679142 -0.499074
H -7.912655 1.089119 -0.148768


