%chk=000051363.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051363

0 1
 O  -6.8700001E-02  -2.319400     -0.3143000    
 O    1.923900      -1.804200      0.4398000    
 O   -3.699300      1.3900000E-02  0.9436000    
 N   0.6720000     -0.1833000     -0.5073000    
 N   0.8537000      -1.519800     -0.1129000    
 N  -0.7857000       1.415500      -1.398500    
 N   -1.587500     -9.6600004E-02  0.2623000    
 N   -2.892600      0.5447000      0.1734000    
 C    1.876300      0.5984000     -0.7986000    
 C    2.083200       1.736800      0.1932000    
 C    2.252200       1.246700       1.624400    
 C  -0.6275000      0.3674000     -0.5051000    
 H    1.816300       1.006900      -1.813900    
 H    2.780300     -2.3800001E-02 -0.8207000    
 H    2.980500       2.296600     -9.6199997E-02
 H    1.248400       2.445200      0.1564000    
 H    3.085800      0.5419000       1.703300    
 H    2.465100       2.092900       2.285800    
 H    1.345700      0.7586000       1.994600    
 H   -1.668200       1.905600      -1.495100    
 H  -5.7200000E-02   1.693800      -2.044100    


%chk=000051363-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051363

0 1
O 0.500752 -2.060439 -1.274320
O 2.585486 -1.189322 -0.988020
O -2.735322 3.165784 -0.387200
N 0.756111 0.227811 -0.765534
N 1.312198 -1.081996 -1.023171
N -1.554062 -0.471565 -1.040608
N -0.937479 1.810140 -0.549595
N -2.368594 1.969774 -0.586843
C 1.727054 1.328164 -0.461859
C 1.866085 1.620408 1.048950
C 2.347966 0.425300 1.897330
C -0.639070 0.498530 -0.792850
H 1.345238 2.220334 -0.981978
H 2.690704 1.023341 -0.898851
H 2.588283 2.456098 1.134017
H 0.898098 2.000836 1.422149
H 3.318649 0.037308 1.540821
H 2.465344 0.728282 2.952894
H 1.622290 -0.409067 1.875263
H -2.525700 -0.146979 -1.026956
H -1.267330 -1.434941 -1.223538


