%chk=000144072.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144072

0 1
 Br   7.167200      0.6719000      0.3285000    
 N   0.6822000     -0.5372000      0.4428000    
 N    1.180800      6.1400000E-02 -0.5300000    
 N   -1.076300      -2.102100      -1.931200    
 N   -1.581700      -1.982700       2.433500    
 C   -1.404500      0.7046000      0.1675000    
 C  -0.7692000     -0.7071000      0.2794000    
 C   -2.886300      0.7490000      2.6000000E-03
 C   -3.446700      0.7346000      -1.274700    
 C   -3.711700      0.8054000       1.125700    
 C   -4.832400      0.7765000      -1.428800    
 C   -5.097400      0.8469000      0.9716000    
 C   -5.657800      0.8324000     -0.3057000    
 C  -0.9408000      -1.486000     -0.9569000    
 C   -1.223400      -1.419500       1.484000    
 C    2.564500      0.2022000     -0.3311000    
 C    3.432600     -0.7853000     -0.7874000    
 C    3.057700       1.328700      0.3205000    
 C    4.806300     -0.6450000     -0.5902000    
 C    4.431400       1.469100      0.5175000    
 C    5.305800      0.4820000      6.2399998E-02
 H  -0.9656000       1.264900     -0.6714000    
 H   -1.132600       1.296200       1.054900    
 H   -2.817000      0.6956000      -2.159500    
 H   -3.290000      0.8222000       2.127100    
 H   -5.268800      0.7664000      -2.423200    
 H   -5.740000      0.8918000       1.846000    
 H   -6.736700      0.8653000     -0.4258000    
 H    3.052000      -1.666000      -1.297600    
 H    2.383400       2.102700      0.6775000    
 H    5.473900      -1.423100     -0.9514000    
 H    4.804200       2.353600       1.027500    


%chk=000144072-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000144072

0 1
Br 7.425147 0.795315 0.534084
N 0.648243 -0.529848 0.180532
N 1.415203 0.010251 -0.709614
N -1.134211 -0.287603 -2.918831
N -1.753201 -2.941336 0.552445
C -1.530068 0.605654 0.499183
C -0.815212 -0.580948 -0.279194
C -3.037886 0.654694 0.329549
C -3.618573 1.386722 -0.737915
C -3.887076 -0.027077 1.238345
C -5.020938 1.434082 -0.895319
C -5.289628 0.018935 1.081631
C -5.860394 0.749728 0.014003
C -0.992908 -0.427507 -1.744122
C -1.339585 -1.893564 0.165732
C 2.792332 0.152210 -0.332168
C 3.345834 -0.276187 0.907055
C 3.615651 0.764890 -1.310198
C 4.714990 -0.085812 1.160426
C 4.989481 0.960462 -1.061716
C 5.522028 0.532668 0.173563
H -1.056962 1.533057 0.128799
H -1.252035 0.479347 1.560737
H -2.973668 1.918919 -1.447637
H -3.451424 -0.595949 2.068728
H -5.456796 2.002582 -1.723976
H -5.934463 -0.512721 1.789699
H -6.948596 0.786240 -0.107617
H 2.700069 -0.754947 1.649294
H 3.162007 1.076652 -2.256045
H 5.156271 -0.411326 2.106600
H 5.629468 1.431817 -1.811953


