%chk=000047283.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047283

1 1
 Br  0.8930000      -3.977800      1.1300000E-02
 N   -1.312700     -0.4594000     -0.3337000    
 N    1.321500      0.3802000       1.147400    
 C  -0.7236000      0.6922000      1.6000001E-02
 C  -0.5129000      -1.626100     -0.7249000    
 C   0.7175000      0.7338000     -9.8999999E-03
 C   -2.644300     -0.6093000     -0.3451000    
 C   -1.496000       1.784800      0.3835000    
 C  -0.2057000      -2.452200      0.5063000    
 C   -3.466500      0.4494000      1.3600000E-02
 C   -2.881800       1.657400      0.3811000    
 C    1.401100       1.113500      -1.154900    
 C    2.790700       1.130800      -1.108900    
 C    2.673100      0.4092000       1.154300    
 C    3.446500      0.7734000      6.3900001E-02
 H   0.3801000      -1.331500      -1.280500    
 H   -1.101500      -2.212200      -1.443800    
 H   -3.046400      -1.573600     -0.6333000    
 H   -1.040600       2.727800      0.6710000    
 H   0.3435000      -1.915700       1.279500    
 H   -1.115800      -2.861600      0.9547000    
 H   -4.545300      0.3369000      9.2000002E-03
 H   -3.505900       2.499200      0.6660000    
 H   0.8822000       1.390500      -2.066900    
 H    3.361500       1.421900      -1.985500    
 H    3.136000      0.1209000       2.092200    
 H    4.528800      0.7793000      0.1225000    


%chk=000047283-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000047283

1 1
Br 0.457703 -4.431900 0.471485
N -1.322413 -0.611264 -0.275863
N 1.520411 -0.212339 0.539006
C -0.665573 0.612162 -0.180119
C -0.601691 -1.931402 -0.469594
C 0.821179 0.717172 -0.190292
C -2.699874 -0.683793 -0.214278
C -1.455080 1.782031 -0.047961
C -0.435855 -2.676953 0.864843
C -3.493307 0.456173 -0.070956
C -2.858998 1.718827 0.006849
C 1.453338 1.786020 -0.877221
C 2.860008 1.897979 -0.803057
C 2.873482 -0.085907 0.606660
C 3.584172 0.953218 -0.043159
H 0.382345 -1.735817 -0.914385
H -1.202267 -2.524058 -1.180761
H -3.130566 -1.683996 -0.300203
H -0.941819 2.740796 0.050938
H 0.233906 -2.127909 1.539442
H -1.394730 -2.925721 1.345647
H -4.579532 0.352138 -0.026706
H -3.448721 2.632647 0.121363
H 0.874215 2.492407 -1.479911
H 3.377044 2.703963 -1.331817
H 3.396482 -0.842156 1.200332
H 4.672640 1.009481 0.044820


