%chk=000022495.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022495

0 1
 O   -1.364500      -2.299800      3.1999999E-03
 N    1.140800       1.523200     -5.5900000E-02
 C  -0.1491000       1.071400     -7.5999998E-02
 C   -1.358800       1.931000     -0.1324000    
 C  -0.1267000     -0.3070000     -3.6400001E-02
 C   -2.555800       1.132600      0.4098000    
 C   -2.651100     -0.2728000     -0.2061000    
 C    1.230100     -0.7041000      1.8600000E-02
 C   -1.358100      -1.073200     -4.8599999E-02
 C    1.991600      0.4468000      3.5999999E-03
 C    1.747100      -2.086200      8.0399998E-02
 C    3.454600      0.6381000      3.9600000E-02
 H   -1.222700       2.843800      0.4576000    
 H   -1.548000       2.225700      -1.171000    
 H   -2.454800       1.033100       1.498900    
 H   -3.483400       1.685400      0.2233000    
 H   -2.874000     -0.2027000      -1.276800    
 H   -3.462100     -0.8269000      0.2789000    
 H    1.422500       2.494000     -7.8000002E-02
 H    1.423400      -2.656100     -0.7966000    
 H    2.840600      -2.117900      0.1104000    
 H    1.376400      -2.594300      0.9768000    
 H    3.926100      0.1494000     -0.8191000    
 H    3.729700       1.697700      1.3400000E-02
 H    3.875100      0.2065000      0.9536000    


%chk=000022495-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022495

0 1
O -1.400896 -2.358381 -0.009677
N 1.142332 1.548870 -0.058271
C -0.170276 1.113596 -0.075494
C -1.404313 1.968223 -0.138807
C -0.137510 -0.298113 -0.027935
C -2.594144 1.146625 0.428838
C -2.669909 -0.266917 -0.200389
C 1.254930 -0.718320 0.025067
C -1.368762 -1.086856 -0.058717
C 2.029764 0.446010 0.003191
C 1.765055 -2.134245 0.087172
C 3.522074 0.642612 0.039041
H -1.280276 2.909265 0.432858
H -1.626828 2.258871 -1.187916
H -2.471859 1.049237 1.524753
H -3.541993 1.688293 0.249155
H -2.887267 -0.180891 -1.286518
H -3.490990 -0.858932 0.241505
H 1.439105 2.524254 -0.073359
H 1.410437 -2.723446 -0.777743
H 2.869071 -2.165281 0.105897
H 1.383294 -2.656221 0.983235
H 4.019095 0.155390 -0.820278
H 3.790069 1.714760 0.007790
H 3.968695 0.219298 0.957801


