%chk=000000559.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000559

0 1
 O    3.861700      4.0199999E-02 -0.5441000    
 N   -1.075500      0.2539000     -0.2062000    
 N   -3.141800       1.304100     -0.2118000    
 N   -3.112400     -0.9193000      0.2887000    
 C    1.158200     -0.7373000     -0.2898000    
 C  -0.3197000     -0.9841000     -1.0800000E-02
 C    1.765200      0.2987000      0.6537000    
 C    3.224700      0.5589000      0.3664000    
 C   -2.360500      0.1849000     -4.6200000E-02
 H    1.704500      -1.684000     -0.1977000    
 H    1.282200     -0.4025000      -1.327600    
 H  -0.4381000      -1.348000       1.017000    
 H  -0.6748000      -1.760800     -0.6988000    
 H    1.247400       1.259900      0.5705000    
 H    1.688700     -4.2100001E-02   1.691900    
 H    3.710200       1.280100       1.046400    
 H   -2.730800       2.197500     -0.4598000    
 H   -4.148000       1.271300     -9.0200000E-02
 H   -4.119900     -0.8550000      0.3869000    
 H   -2.695400      -1.829100      0.4505000    


%chk=000000559-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000559

0 1
O 3.778694 0.330531 -0.797338
N -1.068640 0.202592 0.068960
N -3.079633 1.370664 -0.270059
N -3.217325 -0.933089 0.153582
C 1.150943 -0.823918 -0.235010
C -0.322287 -1.069511 0.155229
C 1.789499 0.256183 0.652639
C 3.171488 0.704213 0.237469
C -2.379073 0.184590 0.000963
H 1.721921 -1.769627 -0.163325
H 1.197815 -0.497372 -1.289277
H -0.354259 -1.476241 1.193984
H -0.741735 -1.858556 -0.514952
H 1.117007 1.143147 0.655129
H 1.840780 -0.063285 1.716944
H 3.652442 1.438401 0.938958
H -2.492024 2.182451 -0.452384
H -3.984638 1.530021 0.170142
H -4.140549 -0.943956 -0.274523
H -2.814526 -1.819941 0.441868


