%chk=000063901.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063901

0 1
 Br   4.004900      -2.619300     -0.9891000    
 Br   4.946100       2.912800     -0.2323000    
 O  -0.2279000       1.828600       1.036600    
 N  -0.6110000     -0.4589000      0.7182000    
 N   -4.291600      3.4000002E-02  0.3406000    
 N    1.155500      -1.857600     -4.1499998E-02
 C   -2.008200     -0.3494000       1.134500    
 C   -2.895400     -5.7599999E-02 -7.2099999E-02
 C   -5.151200      0.3225000     -0.7984000    
 C  -7.2200000E-02  -1.686600      0.3382000    
 C   0.1650000      0.7104000      0.7159000    
 C    1.568200      0.5344000      0.2848000    
 C    2.003800     -0.7433000     -7.5300001E-02
 C   -4.747200       1.644600      -1.444700    
 C   -6.605800      0.3580000     -0.3406000    
 C  -0.9722000      -2.899200      0.3674000    
 C    2.440800       1.627600      0.2398000    
 C    3.331500     -0.9147000     -0.4832000    
 C    3.760700       1.441700     -0.1689000    
 C    4.206300      0.1720000     -0.5299000    
 H   -2.330900      -1.260400       1.647100    
 H   -2.099300      0.4653000       1.863900    
 H   -2.540100      0.8860000     -0.4988000    
 H   -2.772800     -0.8275000     -0.8415000    
 H   -5.062700     -0.4773000      -1.545100    
 H   -4.577800     -0.8418000      0.7777000    
 H   -5.515900       1.969600      -2.155900    
 H   -4.634900       2.443900     -0.7032000    
 H   -3.818900       1.564000      -2.019000    
 H   -6.902400     -0.5975000      0.1063000    
 H   -7.274500      0.5475000      -1.187300    
 H   -6.773700       1.146000      0.4024000    
 H   -1.885800      -2.736800     -0.2056000    
 H   -1.226500      -3.145100       1.402300    
 H  -0.4521000      -3.760300     -6.4599998E-02
 H    2.096800       2.619900      0.5210000    
 H    5.237000      3.0200001E-02 -0.8481000    


%chk=000063901-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063901

0 1
Br 4.401582 -2.499588 0.166575
Br 4.530220 3.125351 -1.172118
O -0.742029 1.665089 -0.035904
N -0.704921 -0.610140 0.544561
N -4.394485 -0.516218 -0.418598
N 1.328207 -1.901938 0.517756
C -2.182206 -0.532763 0.724909
C -2.948598 -0.688670 -0.621222
C -5.017630 0.747787 -0.893953
C 0.016859 -1.806307 0.711795
C -0.067345 0.604133 0.133283
C 1.390953 0.502793 -0.063357
C 2.036592 -0.762029 0.134136
C -4.479669 1.965193 -0.110437
C -6.547613 0.623183 -0.747714
C -0.723807 -3.049065 1.147029
C 2.113517 1.659297 -0.450632
C 3.450167 -0.817145 -0.077217
C 3.494580 1.551202 -0.640754
C 4.178298 0.320068 -0.458751
H -2.510822 -1.302105 1.438504
H -2.411574 0.457806 1.145301
H -2.548795 0.058177 -1.337825
H -2.732826 -1.690976 -1.043334
H -4.782159 0.914877 -1.976073
H -4.945271 -1.339724 -0.680559
H -4.950520 2.893005 -0.484989
H -4.717771 1.858742 0.964209
H -3.385647 2.077612 -0.218660
H -6.943509 -0.230547 -1.332021
H -7.046420 1.539297 -1.109682
H -6.816866 0.472830 0.313689
H -1.570935 -3.288125 0.479496
H -1.123210 -2.947400 2.173379
H -0.007945 -3.882746 1.132467
H 1.569013 2.597310 -0.588294
H 5.258183 0.257433 -0.613393


