%chk=000064608.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064608

0 1
 Br   4.958700       2.664000     -6.9999998E-04
 O   0.1216000      0.4293000      1.2000001E-03
 O   0.3442000      -1.852500     -1.0000000E-03
 N    4.515100      -1.456100     -1.1000000E-03
 C   -1.291700      0.2891000      1.0000000E-03
 C   -3.276000     -0.6213000       1.259400    
 C   -3.467200       1.560800      4.1000000E-03
 C   -3.275900     -0.6126000      -1.264300    
 C   -1.744700     -0.4836000       1.252800    
 C   -1.935100       1.687500      3.8000001E-03
 C   -1.744800     -0.4736000      -1.255800    
 C   -3.908900      0.7818000       1.256200    
 C   -3.719700      -1.378300     -5.1000002E-03
 C   -3.909800      0.7899000      -1.252300    
 C   0.8508000     -0.7353000      1.9999999E-04
 C    2.299800     -0.5165000      9.9999997E-05
 C    2.819300      0.7660000      1.3000000E-03
 C    3.169500      -1.586500     -1.2000001E-03
 C    4.198700      0.9407000      1.3000000E-03
 C    4.996000     -0.1926000       0.000000    
 H   -3.597100      -1.168700       2.152600    
 H   -3.922200       2.557400      7.4999998E-03
 H   -3.596000      -1.154300      -2.161300    
 H   -1.410500      4.8799999E-02   2.153500    
 H   -1.326500      -1.487600       1.347300    
 H   -1.597300       2.260400     -0.8696000    
 H   -1.597000       2.256200      0.8797000    
 H   -1.324900      -1.476400      -1.356900    
 H   -1.410500      6.5099999E-02  -2.152800    
 H   -5.002500      0.6987000       1.278200    
 H   -3.612700       1.328000       2.160200    
 H   -3.287200      -2.386400     -8.5000005E-03
 H   -4.809900      -1.499100     -5.5999998E-03
 H   -5.003300      0.7064000      -1.274100    
 H   -3.614400       1.341800      -2.153100    
 H    2.176100       1.641700      1.9000000E-03
 H    2.821100      -2.614400     -2.2000000E-03
 H    6.079700     -0.1251000     -6.9999998E-04


%chk=000064608-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064608

0 1
Br 4.922601 2.895044 0.004305
O 0.154847 0.226815 0.001218
O 0.553369 -2.090743 -0.004520
N 4.727648 -1.321925 -0.002371
C -1.361536 0.108610 0.000495
C -3.414085 -0.599323 1.267517
C -3.395721 1.599500 0.004033
C -3.413333 -0.592157 -1.271644
C -1.857219 -0.617159 1.273257
C -1.840958 1.576026 0.004368
C -1.856457 -0.610117 -1.276532
C -3.920388 0.868944 1.270442
C -3.930649 -1.326979 -0.004254
C -3.919584 0.876125 -1.266773
C 0.960358 -0.901455 -0.001346
C 2.413101 -0.528464 -0.000840
C 2.852945 0.819726 0.001283
C 3.385787 -1.561491 -0.002609
C 4.238870 1.057916 0.001480
C 5.149995 -0.023734 -0.000367
H -3.778977 -1.123514 2.171807
H -3.739704 2.651681 0.006916
H -3.777714 -1.111310 -2.179041
H -1.469839 -0.095621 2.169876
H -1.486029 -1.655894 1.288902
H -1.443032 2.096429 -0.887585
H -1.443518 2.091497 0.899394
H -1.485302 -1.648768 -1.297641
H -1.468458 -0.083694 -2.170037
H -5.027962 0.888481 1.285963
H -3.569876 1.389924 2.183741
H -3.582026 -2.378549 -0.007129
H -5.038336 -1.347740 -0.004611
H -5.027145 0.895810 -1.282966
H -3.568401 1.402170 -2.176908
H 2.122006 1.631166 0.002684
H 3.067866 -2.608539 -0.004223
H 6.231658 0.144015 -0.000283


