%chk=000026715.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026715

0 1
 O   0.1535000      0.4199000      -1.209800    
 N    1.168300     -0.4819000      0.6734000    
 N    2.284400     -0.7926000       1.385800    
 C   -1.697600      0.9760000      0.2085000    
 C   -1.032800      8.1900001E-02 -0.6309000    
 C   -2.911500      0.6133000      0.7923000    
 C   -1.582000      -1.174700     -0.8864000    
 C   -1.124900       2.325100      0.4932000    
 C   -3.460500     -0.6433000      0.5366000    
 C   -2.795800      -1.537200     -0.3027000    
 C    1.314100      0.1205000     -0.5176000    
 C    2.526200      0.4480000      -1.071600    
 C    3.661900      0.1319000     -0.3468000    
 C    3.496500     -0.4871000      0.8759000    
 H   -3.440700       1.297800       1.449800    
 H   -1.071100      -1.876400      -1.540300    
 H  -0.2803000       2.241500       1.184400    
 H  -0.7882000       2.809100     -0.4297000    
 H   -1.867100       2.990500      0.9475000    
 H   -4.405400     -0.9259000      0.9915000    
 H   -3.223400      -2.515600     -0.5017000    
 H    2.600600      0.9348000      -2.037100    
 H    4.650100      0.3633000     -0.7274000    
 H    4.345900     -0.7601000       1.491100    


%chk=000026715-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026715

0 1
O 0.175670 0.168759 -1.187087
N 1.298117 -0.196297 0.872309
N 2.475557 -0.295332 1.584912
C -1.689315 0.880831 0.292043
C -1.099195 -0.085394 -0.558808
C -2.999279 0.600299 0.756635
C -1.760748 -1.262281 -0.953923
C -0.958048 2.142149 0.697044
C -3.682825 -0.580277 0.387345
C -3.064289 -1.515197 -0.473308
C 1.355209 0.085926 -0.461707
C 2.560450 0.299035 -1.185394
C 3.750698 0.195360 -0.455788
C 3.660803 -0.107410 0.930436
H -3.486012 1.325738 1.419194
H -1.253277 -1.960624 -1.626471
H -0.171216 1.902526 1.436641
H -0.463695 2.621022 -0.167704
H -1.648632 2.872324 1.151231
H -4.694254 -0.765872 0.764771
H -3.587427 -2.430499 -0.769522
H 2.528471 0.526922 -2.253519
H 4.724316 0.341892 -0.932627
H 4.549122 -0.204798 1.561298


