%chk=000036863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036863

0 1
 Br  -5.342500     -0.6593000     -4.8900001E-02
 O    5.977200       1.087600     -0.1145000    
 O    5.241700      -1.055600      3.2400001E-02
 N    1.233200      0.3906000      4.6599999E-02
 C   -1.228300      0.3390000      1.4100000E-02
 C   9.9999998E-03 -0.3235000      2.4100000E-02
 C   -2.420700     -0.4228000     -8.3999997E-03
 C    2.504000     -0.2580000      5.6899998E-02
 C   7.1500003E-02  -1.717300      1.2100000E-02
 C   -1.309400       1.741100      2.6100000E-02
 C   -2.339800      -1.824900     -2.0800000E-02
 C    3.627800      0.7711000      1.4900000E-02
 C   -3.659000      0.2396000     -1.8500000E-02
 C   -1.100900      -2.466500     -1.0500000E-02
 C   -2.548400       2.382500      1.6300000E-02
 C   -3.721000       1.633400     -6.0000001E-03
 C    5.004700      0.1433000     -1.5900001E-02
 H    2.620000     -0.8707000      0.9597000    
 H    2.611300     -0.9158000     -0.8150000    
 H    1.212800       1.400200      8.1600003E-02
 H    1.006300      -2.269000      2.2399999E-02
 H  -0.4347000       2.383100      4.2199999E-02
 H   -3.220200      -2.460300     -3.8199998E-02
 H    3.571000       1.419900      0.8969000    
 H    3.522100       1.395600     -0.8803000    
 H   -1.052500      -3.551700     -1.9300001E-02
 H   -2.597700       3.467600      2.5599999E-02
 H   -4.674100       2.156600     -1.3500000E-02
 H    6.872900      0.6883000     -0.1388000    


%chk=000036863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036863

0 1
Br -5.421120 -0.674348 0.018495
O 6.022634 1.170896 0.062168
O 5.325903 -1.034837 -0.158910
N 1.236918 0.355501 0.028706
C -1.232331 0.334125 0.001907
C 0.045313 -0.369296 0.008817
C -2.462824 -0.446335 -0.001098
C 2.554555 -0.282842 0.059970
C 0.058802 -1.779751 -0.013921
C -1.311287 1.763610 -0.005402
C -2.398470 -1.876654 -0.022871
C 3.653925 0.788812 -0.022139
C -3.698663 0.289890 0.012235
C -1.157445 -2.514929 -0.035023
C -2.540633 2.426156 0.005562
C -3.757261 1.681929 0.019633
C 5.041251 0.176781 -0.046647
H 2.691944 -0.890243 0.980680
H 2.661598 -0.979467 -0.793979
H 1.196647 1.355254 0.213196
H 1.007660 -2.322925 -0.005285
H -0.403055 2.376171 -0.039447
H -3.324972 -2.455611 -0.028737
H 3.603110 1.494902 0.828922
H 3.534195 1.396339 -0.941291
H -1.110790 -3.609471 -0.052343
H -2.582854 3.520058 -0.003018
H -4.720666 2.198706 0.030011
H 6.925214 0.751678 0.023110


