%chk=000101168.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101168

0 1
 Br -0.2434000      -3.831300       1.188200    
 Br   2.973800      -3.143800      0.2859000    
 O    2.082200      -1.028400      -1.935100    
 O   -4.867800       1.411500     -0.9535000    
 O   -4.357700       1.944800       1.118500    
 N   -4.150800       1.290500      6.8499997E-02
 C   0.2130000      -2.375400     -6.3400000E-02
 C    1.571100      -1.767800      0.3067000    
 C  -0.9457000      -1.401400     -2.8100001E-02
 C    2.047300     -0.7309000     -0.7264000    
 C   -1.742700      -1.260800      -1.150200    
 C   -1.181600     -0.6744000       1.125300    
 C    2.425400      0.6060000     -0.2971000    
 C   -2.810500     -0.3638000      -1.118000    
 C   -2.249400      0.2225000       1.157600    
 C   -3.063900      0.3777000      3.5999998E-02
 C    2.960100      0.8049000      0.9758000    
 C    2.253000       1.689600      -1.158200    
 C    3.322400       2.087400       1.387600    
 C    2.615300       2.972200     -0.7465000    
 C    3.150100       3.171000      0.5264000    
 H   0.2651000      -2.877400      -1.037300    
 H    1.570500      -1.383000       1.327400    
 H   -1.554200      -1.832300      -2.054100    
 H  -0.5617000     -0.7792000       2.010500    
 H   -3.423300     -0.2691000      -2.010800    
 H   -2.416400      0.7832000       2.073800    
 H    3.141800     -1.4600000E-02   1.663800    
 H    1.833000       1.556400      -2.151800    
 H    3.745900       2.241700       2.375800    
 H    2.480200       3.816300      -1.416500    
 H    3.433600       4.169400      0.8464000    


%chk=000101168-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101168

0 1
Br -0.058189 -3.911855 1.261206
Br 3.127898 -2.712218 0.201542
O 1.222600 -0.492842 -1.839554
O -5.269876 1.035340 -1.106588
O -4.873147 1.614149 1.064227
N -4.577089 0.976645 -0.019038
C 0.189093 -2.343156 -0.033962
C 1.454057 -1.550894 0.331204
C -1.061952 -1.485569 -0.001176
C 1.696622 -0.393486 -0.669627
C -1.854244 -1.379015 -1.172753
C -1.444073 -0.772548 1.166789
C 2.461269 0.810375 -0.225501
C -3.010665 -0.576465 -1.187291
C -2.593363 0.037561 1.168886
C -3.361036 0.123813 -0.013399
C 3.097334 0.907769 1.043195
C 2.543336 1.906357 -1.130206
C 3.796934 2.079654 1.397514
C 3.238399 3.076310 -0.771877
C 3.866472 3.166642 0.494501
H 0.315572 -2.825598 -1.013024
H 1.438217 -1.220509 1.380156
H -1.552842 -1.913219 -2.078977
H -0.859990 -0.877350 2.087438
H -3.634096 -0.479268 -2.079646
H -2.908916 0.591977 2.056333
H 3.080545 0.068755 1.746571
H 2.052205 1.812135 -2.104176
H 4.291315 2.145344 2.372351
H 3.293465 3.916231 -1.472288
H 4.408845 4.076435 0.774370


