%chk=000000776.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000776

0 1
 O   -2.212600      -1.728000     -1.8300001E-02
 N   -2.950200       1.049800     -0.2856000    
 N    1.499800     -0.6531000     -0.8954000    
 N    2.740000      0.2237000      0.7248000    
 C   -1.661400      0.6388000      0.2834000    
 C  -0.5992000      0.6858000     -0.8319000    
 C   0.7867000      0.3412000     -0.3375000    
 C   -1.824800     -0.7430000      0.9306000    
 C    1.535300      0.8764000      0.6471000    
 C    2.686300     -0.6915000     -0.2172000    
 H   -1.393200       1.354800       1.070100    
 H  -0.8793000      1.1400000E-02  -1.652100    
 H  -0.5569000       1.696100      -1.260900    
 H  -0.8910000      -1.068400       1.400300    
 H   -2.591200     -0.7076000       1.713700    
 H   -2.875100       1.997000     -0.6545000    
 H   -3.654300       1.083900      0.4505000    
 H    1.226700      -1.257000      -1.660000    
 H    1.297300       1.692500       1.313700    
 H    3.462200      -1.404500     -0.4573000    
 H   -2.295600      -2.569700      0.4614000    


%chk=000000776-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000000776

0 1
O -1.544534 -1.791468 -0.172447
N -3.023615 0.611134 -0.329705
N 1.120157 -0.839607 -0.343931
N 3.015401 0.230630 0.274600
C -1.747436 0.583882 0.438564
C -0.605475 1.014095 -0.543041
C 0.775649 0.517070 -0.221458
C -1.591096 -0.858434 0.965898
C 1.963512 1.156307 0.154578
C 2.466077 -0.965063 -0.030907
H -1.740776 1.271797 1.314296
H -0.894851 0.656544 -1.552615
H -0.581093 2.118165 -0.589821
H -0.652777 -0.985819 1.527077
H -2.441429 -1.111856 1.633364
H -3.078607 1.362681 -1.026180
H -3.866671 0.582320 0.255606
H 0.415895 -1.567127 -0.543774
H 2.128206 2.216720 0.337078
H 2.995457 -1.914767 -0.036869
H -2.262493 -1.458605 -0.785416


