%chk=000028545.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028545

0 1
 O  -0.1939000       2.067100      8.8600002E-02
 O   -3.271900      -1.559500      0.4746000    
 N   -1.074000     -4.6100002E-02 -0.2637000    
 N   -2.363900      0.4229000     -0.3251000    
 N    1.366100      -1.047500     -0.1982000    
 C    1.320500      0.2772000     -1.8100001E-02
 C  -4.8200000E-02  0.8554000     -5.2299999E-02
 C    2.388000       1.109500      0.1870000    
 C    3.646000      0.5175000      0.2107000    
 C    3.765300     -0.8562000      3.0200001E-02
 C   -3.394900     -0.4069000      6.4999998E-02
 C    2.605300      -1.587200     -0.1687000    
 C   -4.744200      0.2538000     -2.9899999E-02
 H    2.292800       2.179700      0.3278000    
 H  -0.9316000      -1.042200     -0.3966000    
 H   -2.498500       1.370000     -0.6642000    
 H    4.531800       1.125100      0.3695000    
 H    4.735600      -1.339100      4.4799998E-02
 H    2.644200      -2.661700     -0.3144000    
 H   -4.977400      0.7309000      0.9257000    
 H   -4.760900       1.007300     -0.8225000    
 H   -5.502800     -0.5009000     -0.2555000    


%chk=000028545-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028545

0 1
O -0.259306 2.198629 -0.112403
O -3.204016 -1.661029 -0.018595
N -1.069549 0.027659 -0.043762
N -2.381374 0.493064 -0.077901
N 1.367518 -1.054907 0.026872
C 1.319051 0.314356 -0.023808
C -0.043624 0.938550 -0.063871
C 2.470199 1.133456 -0.039177
C 3.735855 0.508247 0.000049
C 3.801547 -0.903378 0.052859
C -3.430470 -0.411133 -0.064465
C 2.593110 -1.642386 0.064168
C -4.816086 0.208348 -0.107357
H 2.344210 2.219039 -0.080709
H -0.924961 -0.989890 -0.006120
H -2.448515 1.515883 -0.117276
H 4.651793 1.107869 -0.010077
H 4.762267 -1.426166 0.084702
H 2.602240 -2.737009 0.104194
H -5.383864 -0.112721 0.782866
H -4.798587 1.311021 -0.141282
H -5.354039 -0.168401 -0.994208


