%chk=000178461.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178461

0 1
 Br  0.5506000       2.373900     -0.7860000    
 Br   5.709400      0.4827000      0.7024000    
 O   -2.801300     -0.1652000      0.8550000    
 O   -2.010400     -0.3169000      -1.304300    
 O   0.6302000      -1.944700      -1.118800    
 N    3.048100     -0.6089000      0.2154000    
 N    3.205100       1.590700     -4.6300001E-02
 C   -4.085500      0.2152000      0.3593000    
 C   -4.616500     -0.9091000     -0.5287000    
 C   -4.999700      0.4257000       1.564300    
 C   -3.936000       1.512100     -0.4347000    
 C  -0.5507000     -0.7625000      0.5965000    
 C   -1.845700     -0.4040000     -9.6000001E-02
 C    1.834900     -0.1578000     -0.1353000    
 C   0.6544000      -1.025500     -0.2991000    
 C    1.920700       1.176400     -0.2961000    
 C    3.858100      0.4915000      0.2590000    
 C    3.434300      -1.973700      0.4933000    
 H   -4.459400      -1.887500     -5.9900001E-02
 H   -5.693300     -0.7871000     -0.6966000    
 H   -4.167700     -0.9527000      -1.524200    
 H   -4.595300       1.198100       2.228500    
 H   -5.071100     -0.4902000       2.162300    
 H   -6.009800      0.7222000       1.263400    
 H   -3.492100       1.390100      -1.425800    
 H   -4.916800       1.972500     -0.6038000    
 H   -3.315500       2.234400      0.1085000    
 H  -0.7160000      -1.679800       1.174100    
 H  -0.3089000      3.6600001E-02   1.306100    
 H    3.965500      -2.361700     -0.3793000    
 H    4.077700      -1.991000       1.376500    
 H    2.550500      -2.581600      0.6979000    


%chk=000178461-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178461

0 1
Br 0.223508 2.364749 1.278393
Br 5.033468 0.773191 -1.393083
O -2.810887 -0.080865 0.991076
O -1.353838 -0.753256 -0.726090
O 1.092411 -2.497799 1.305571
N 2.828311 -0.561797 -0.059217
N 2.645739 1.710481 -0.060263
C -3.981189 0.288017 0.062656
C -4.440540 -0.975271 -0.690485
C -5.039039 0.767530 1.069611
C -3.536613 1.421146 -0.881785
C -0.681626 -0.900371 1.651195
C -1.620723 -0.571346 0.484356
C 1.598576 -0.256735 0.601681
C 0.720095 -1.287050 1.183374
C 1.548780 1.164132 0.565509
C 3.384186 0.646635 -0.429077
C 3.382201 -1.890956 -0.398608
H -4.687820 -1.783602 0.020191
H -5.350633 -0.740150 -1.272162
H -3.663662 -1.331139 -1.385092
H -4.665656 1.632830 1.643747
H -5.295791 -0.037845 1.778911
H -5.956142 1.070447 0.533383
H -2.769880 1.075317 -1.592277
H -4.411684 1.780740 -1.453497
H -3.131058 2.270194 -0.303560
H -1.092154 -1.776403 2.184167
H -0.675525 -0.053056 2.357069
H 3.322419 -2.052632 -1.488561
H 4.436548 -1.940418 -0.080552
H 2.796014 -2.652515 0.131018


