%chk=000134187.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134187

0 1
 Br   4.020300       2.406600     -0.3768000    
 O   -1.587500       1.640000     -0.5787000    
 O   -4.026800      0.2983000     -0.5606000    
 O    2.114400      -2.876700     -3.5599999E-02
 O   1.1000000E-03  -2.323700     -0.2931000    
 N   0.7376000      0.3183000      0.5213000    
 N    2.707900     -0.1481000     -0.3480000    
 N    1.208600      -1.997700     -0.1088000    
 C  -0.6235000      0.1334000       1.024300    
 C   -1.677800      0.3075000     -7.0500001E-02
 C   -3.082900      9.7300000E-02  0.4857000    
 C    1.547000     -0.6457000      1.6600000E-02
 C    1.397500       1.502100      0.4868000    
 C    2.621400       1.190300     -5.7000000E-02
 C   -5.357300      9.8200001E-02 -0.1054000    
 H  -0.6866000     -0.8368000       1.526300    
 H  -0.7585000      0.8983000       1.800800    
 H   -1.515700     -0.3642000     -0.9198000    
 H   -3.285900      0.8229000       1.282700    
 H   -3.183700     -0.9180000      0.8861000    
 H   0.9665000       2.430900      0.8357000    
 H  -0.8049000       1.685700      -1.153500    
 H   -6.037300      0.2657000     -0.9450000    
 H   -5.602800      0.8095000      0.6891000    
 H   -5.490900     -0.9274000      0.2520000    


%chk=000134187-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134187

0 1
Br 4.069497 2.406156 -0.670689
O -1.578230 1.772177 -0.342423
O -3.939063 0.449691 -0.573056
O 2.386097 -2.973356 -0.090398
O 0.176475 -2.516837 0.308788
N 0.794254 0.247377 0.537199
N 2.868006 -0.208151 -0.314307
N 1.418986 -2.155165 0.113297
C -0.577509 0.125458 1.087162
C -1.638096 0.345934 0.000999
C -3.046945 -0.015520 0.494782
C 1.701576 -0.737415 0.116743
C 1.434866 1.464112 0.340873
C 2.704716 1.148263 -0.179048
C -5.356962 0.275565 -0.254645
H -0.687290 -0.872026 1.534032
H -0.697306 0.904011 1.860171
H -1.407292 -0.276467 -0.887493
H -3.283414 0.510057 1.446858
H -3.144360 -1.111818 0.642200
H 0.943768 2.409873 0.545850
H -2.383232 1.963090 -0.893695
H -5.916766 0.661262 -1.120246
H -5.638065 0.845507 0.655336
H -5.603510 -0.795077 -0.103690


