%chk=000045036.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045036

0 1
 Br   2.147700       3.186400     -0.1806000    
 Br   3.692100      -2.358000      0.2061000    
 O   -1.687900      -1.906300     -0.4859000    
 N   -2.284000      0.1486000      0.4081000    
 N    4.095400      0.7430000      3.5200000E-02
 C   -3.706200     -0.1012000      0.4685000    
 C   -4.672500       1.031800      0.4603000    
 C   -4.562000      0.1240000     -0.7294000    
 C   -1.354800     -0.7819000     -7.1300000E-02
 C   4.5600001E-02 -0.3901000     -4.5000002E-02
 C    1.040400      -1.363600      4.8999999E-02
 C   0.3940000      0.9589000     -0.1126000    
 C    1.737000       1.334700     -8.6300001E-02
 C    2.383500     -0.9876000      7.5800002E-02
 C    2.731800      0.3615000      8.0000004E-03
 H   -3.951500     -0.9443000       1.106000    
 H   -4.291500       2.040700      0.3594000    
 H   -5.558200      0.9474000       1.078000    
 H   -5.372100     -0.5715000     -0.9108000    
 H   -4.105900      0.5245000      -1.626600    
 H   -1.971900       1.028500      0.8079000    
 H   0.7700000      -2.415700      0.1068000    
 H  -0.3619000       1.732600     -0.2189000    
 H    4.815100      3.5799999E-02  0.1032000    
 H    4.345800       1.721500     -1.4700000E-02


%chk=000045036-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000045036

0 1
Br 2.334273 3.267786 -0.047220
Br 3.719435 -2.418816 -0.023774
O -1.743211 -1.938188 -0.232545
N -2.347678 0.202137 0.445417
N 4.178045 0.700735 -0.031886
C -3.760152 -0.115086 0.490838
C -4.762159 1.032481 0.351911
C -4.604090 0.006767 -0.784271
C -1.407236 -0.750061 0.069505
C 0.030207 -0.306251 0.051751
C 1.022564 -1.319625 0.024051
C 0.443022 1.051240 0.029503
C 1.807400 1.368592 0.001424
C 2.376294 -0.978911 0.000830
C 2.839181 0.377412 -0.007899
H -4.013816 -0.941518 1.163523
H -4.369889 2.039825 0.176174
H -5.663566 1.001073 0.969593
H -5.392086 -0.733610 -0.942283
H -4.085219 0.329194 -1.690615
H -2.038947 1.081672 0.861098
H 0.691494 -2.362232 0.013012
H -0.284940 1.867591 -0.006614
H 4.878340 -0.037706 -0.047729
H 4.470734 1.675200 -0.043591


