%chk=000020272.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020272

0 1
 O    3.352200      0.1198000       1.064000    
 N    1.149500      -1.326800      0.1620000    
 N    1.848600     -0.4280000     -0.6267000    
 C  -0.2396000      -1.402900     -0.2694000    
 C  -0.9514000      -2.561600      0.4584000    
 C  -0.9245000     -5.9500001E-02 -9.4999999E-02
 C   -2.383000      -2.774600     -2.0099999E-02
 C   -1.892000      0.3236000      -1.004200    
 C  -0.5622000      0.7452000      0.9681000    
 C   -2.521100       1.558100     -0.8440000    
 C   -1.191300       1.979800       1.128400    
 C   -2.170900       2.386200      0.2224000    
 C    2.929600      0.2408000     -8.3600000E-02
 C    3.556100       1.199900      -1.060200    
 H  -0.2431000      -1.653900      -1.341000    
 H  -0.3933000      -3.492500      0.2947000    
 H  -0.9641000      -2.384200       1.541400    
 H    1.598300      -2.234400      4.1200001E-02
 H   -2.425400      -2.891200      -1.107500    
 H   -3.037100      -1.949100      0.2744000    
 H   -2.791300      -3.685700      0.4299000    
 H   -2.169700     -0.3108000      -1.840500    
 H   0.1755000      0.4474000       1.706900    
 H    1.569100     -0.3008000      -1.595000    
 H   -3.283300       1.874900      -1.549800    
 H  -0.9232000       2.622200       1.962200    
 H   -2.661800       3.346800      0.3480000    
 H    4.559500       1.468600     -0.7186000    
 H    3.636700      0.7426000      -2.050500    
 H    2.942100       2.102300      -1.125300    


%chk=000020272-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020272

0 1
O 2.778758 0.580749 1.159609
N 1.167610 -1.463273 0.000433
N 2.017045 -0.604779 -0.718078
C -0.263134 -1.460873 -0.385782
C -0.955939 -2.566303 0.465200
C -0.892595 -0.084116 -0.168674
C -2.417298 -2.836724 0.057028
C -1.865062 0.406825 -1.073983
C -0.549530 0.695490 0.965162
C -2.503325 1.647917 -0.845496
C -1.183084 1.936580 1.192030
C -2.165617 2.415529 0.292735
C 2.753022 0.405898 -0.088709
C 3.546809 1.279866 -1.060903
H -0.397289 -1.735788 -1.464344
H -0.370973 -3.505590 0.363357
H -0.901944 -2.265055 1.527923
H 1.569147 -2.398905 0.137186
H -2.486816 -3.165251 -0.997535
H -3.036998 -1.930468 0.172022
H -2.855461 -3.631298 0.687241
H -2.123571 -0.182766 -1.963552
H 0.241021 0.338610 1.634941
H 2.037802 -0.660339 -1.745463
H -3.255179 2.015251 -1.553533
H -0.903209 2.534848 2.066578
H -2.654996 3.379805 0.472022
H 4.607110 1.285239 -0.756983
H 3.477333 0.954632 -2.114093
H 3.175262 2.316490 -0.985739


