%chk=000023603.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023603

0 1
 O   0.9036000       2.113100      -1.499600    
 N   -1.088800       2.897700     -0.6397000    
 C   5.1000002E-03  0.9989000      0.3890000    
 C    1.300300      0.2019000      0.3800000    
 C   -1.289700      0.2108000      0.4117000    
 C   0.5609000      -1.707200      -1.244900    
 C  -0.6831000     -0.9769000      -1.735400    
 C    1.547400     -0.9707000     -0.3631000    
 C   -1.633400     -0.6947000     -0.6057000    
 C    2.354700      0.7351000       1.161000    
 C   -2.198900      0.4184000       1.466200    
 C  -5.2000000E-03   2.052700     -0.6798000    
 C    2.820200      -1.580700     -0.2608000    
 C   -2.864800      -1.369300     -0.5512000    
 C    3.604400      0.1225000       1.235300    
 C   -3.418000     -0.2579000       1.511300    
 C    3.836900      -1.042400      0.5247000    
 C   -3.751800      -1.151200      0.5009000    
 H   1.7000001E-02   1.570600       1.330700    
 H    1.101500      -2.032900      -2.144600    
 H   0.2588000      -2.619200     -0.7117000    
 H   -1.181300      -1.610600      -2.480800    
 H  -0.4287000     -5.5100001E-02  -2.267100    
 H    2.204000       1.652300       1.728200    
 H   -1.965000       1.118400       2.265400    
 H    3.025900      -2.499200     -0.8087000    
 H   -3.138800      -2.077400      -1.329700    
 H    4.388800      0.5568000       1.847500    
 H   -4.105600     -8.3499998E-02   2.333500    
 H    4.803900      -1.533200      0.5771000    
 H   -4.699700      -1.679900      0.5317000    
 H   -1.190900       3.641500      -1.322200    
 H   -1.809300       2.838000      7.1999997E-02


%chk=000023603-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000023603

0 1
O 1.101521 2.542518 -1.267785
N -1.201828 2.655506 -1.038927
C 0.025408 1.048925 0.414093
C 1.316815 0.217339 0.408657
C -1.277830 0.256450 0.484392
C 0.558815 -1.609817 -1.345915
C -0.715122 -0.828166 -1.748378
C 1.547554 -0.949985 -0.377328
C -1.654074 -0.619327 -0.575641
C 2.356328 0.684387 1.257304
C -2.138625 0.406952 1.599544
C 0.038969 2.126026 -0.727384
C 2.806807 -1.601414 -0.261987
C -2.883537 -1.314724 -0.489047
C 3.599370 0.031213 1.356531
C -3.363407 -0.294798 1.678763
C 3.825927 -1.132297 0.588082
C -3.738950 -1.159074 0.626470
H 0.067465 1.667917 1.334072
H 1.114742 -1.856383 -2.271943
H 0.243865 -2.581036 -0.910756
H -1.235825 -1.399388 -2.539556
H -0.420982 0.138794 -2.198692
H 2.183583 1.593561 1.846160
H -1.842542 1.075548 2.417742
H 2.984593 -2.500626 -0.866459
H -3.172245 -1.988007 -1.305555
H 4.377877 0.424345 2.019259
H -4.013255 -0.168548 2.551587
H 4.783472 -1.661763 0.646062
H -4.686124 -1.707856 0.673899
H -1.249939 3.407379 -1.725914
H -2.058425 2.283049 -0.630152


