%chk=000004657.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004657

0 1
 O    3.201700      0.3420000      0.2868000    
 N   -4.576700     -0.2988000      0.4114000    
 C   -2.352200     -7.1999999E-03 -0.6425000    
 C  -0.8844000      8.4899999E-02 -0.3967000    
 C   -3.144200     -0.1826000      0.6624000    
 C  -0.2908000       1.327800     -0.1771000    
 C  -0.1050000      -1.071900     -0.3866000    
 C    1.861900      0.2573000      6.2799998E-02
 C    1.082300       1.414000      5.2600000E-02
 C    1.268200     -0.9858000     -0.1568000    
 C    3.939200     -0.8795000      0.2838000    
 H   -2.695800      0.8916000      -1.171700    
 H   -2.559000     -0.8448000      -1.322200    
 H   -2.969900      0.6684000       1.330700    
 H   -2.806800      -1.078900       1.195400    
 H  -0.8874000       2.236200     -0.1806000    
 H  -0.5570000      -2.046100     -0.5546000    
 H    1.539100       2.385000      0.2235000    
 H    1.813900      -1.923200     -0.1620000    
 H   -4.750000      -1.087100     -0.2115000    
 H   -4.902300      0.5277000     -8.8799998E-02
 H    3.904800      -1.367800     -0.6960000    
 H    3.617200      -1.545800       1.091200    
 H    4.986400     -0.6253000      0.4776000    


%chk=000004657-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004657

0 1
O 3.258145 0.364098 0.339051
N -4.670537 -0.246583 0.477797
C -2.407541 -0.002503 -0.719653
C -0.906981 0.066264 -0.495078
C -3.206199 -0.176475 0.618732
C -0.262915 1.305735 -0.226035
C -0.111447 -1.104841 -0.478950
C 1.890626 0.187284 0.057871
C 1.115471 1.373971 0.046083
C 1.276124 -1.060726 -0.207342
C 4.098836 -0.834749 0.363761
H -2.769496 0.918840 -1.217797
H -2.663622 -0.851327 -1.384540
H -2.958808 0.663218 1.295269
H -2.857663 -1.096530 1.124811
H -0.851442 2.231739 -0.237829
H -0.579872 -2.074805 -0.689405
H 1.614396 2.326948 0.247666
H 1.856534 -1.988434 -0.210119
H -5.006963 -1.066946 -0.036306
H -5.104296 0.617573 0.137998
H 4.107611 -1.342254 -0.620885
H 3.763671 -1.546864 1.143324
H 5.109569 -0.472534 0.602678


