%chk=000151678.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151678

0 1
 Br  -4.409000       2.674800     -0.3999000    
 O   -5.138600     -0.2859000      0.1362000    
 O   -3.334200      -2.300900      0.6465000    
 O   -1.360100       2.591800     -0.1906000    
 O    3.614500     -0.4792000      -2.838000    
 O    1.659700     -0.7789000      -1.885200    
 N   0.3831000      0.6523000      0.3022000    
 N    2.869300     -0.4571000      -1.831100    
 C   -1.438000     -0.9228000      0.4970000    
 C  -0.9352000      0.3474000      0.2785000    
 C    1.232300     -0.3677000      0.5576000    
 C    2.630100     -7.1999999E-03  0.5753000    
 C  -0.5336000      -1.951400      0.7577000    
 C   0.8290000      -1.672600      0.7896000    
 C   -2.884000      -1.177600      0.4544000    
 C   -1.832500       1.476700     -8.9999998E-04
 C   -3.781200     -2.6400000E-02  0.1712000    
 C    3.416800     -5.2200001E-02 -0.5806000    
 C   -3.297500       1.207100     -4.0800001E-02
 C    3.205700      0.3978000       1.783700    
 C    4.764200      0.3043000     -0.5280000    
 C    4.553300      0.7541000       1.836200    
 C    5.332600      0.7074000      0.6804000    
 C   -5.546700     -0.6340000      -1.171400    
 H  -0.8696000      -2.968600      0.9367000    
 H    1.541700      -2.466000      0.9914000    
 H    2.614500      0.4419000       2.695800    
 H    5.406600      0.2823000      -1.404700    
 H    4.995900       1.068200       2.777000    
 H    6.381800      0.9852000      0.7219000    
 H   -5.329900      0.1532000      -1.901000    
 H   -6.630000     -0.7875000      -1.158900    
 H   -5.081100      -1.572300      -1.492800    


%chk=000151678-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000151678

0 1
Br -4.558069 2.852024 0.895137
O -5.228373 0.081618 -0.071678
O -3.385867 -2.119083 -0.543234
O -1.474159 2.766986 1.133750
O 4.453859 -2.146204 -1.866538
O 2.599764 -0.927565 -2.401024
N 0.363917 0.779539 0.449162
N 3.589658 -1.215935 -1.624634
C -1.482916 -0.729272 -0.069722
C -0.965137 0.528347 0.340390
C 1.252254 -0.220896 0.153520
C 2.690066 0.141251 0.334309
C -0.562839 -1.775783 -0.327342
C 0.812898 -1.527137 -0.206089
C -2.941902 -0.974052 -0.210259
C -1.908426 1.664532 0.696849
C -3.867533 0.177330 0.063047
C 3.785650 -0.397363 -0.398258
C -3.353906 1.395398 0.499891
C 3.006300 1.049483 1.379865
C 5.128057 -0.108326 -0.070278
C 4.340673 1.371380 1.701745
C 5.408271 0.777413 0.988850
C -5.946206 -1.112783 -0.588838
H -0.945732 -2.759709 -0.613635
H 1.531155 -2.333240 -0.373797
H 2.170721 1.494474 1.927775
H 5.926628 -0.561179 -0.664160
H 4.546182 2.078412 2.511766
H 6.446626 1.014554 1.240374
H -5.591414 -1.380221 -1.596233
H -6.993447 -0.777119 -0.613114
H -5.816850 -1.970676 0.087803


