%chk=000012194.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012194

0 1
 O  -5.1000002E-03  -1.008600      3.9999999E-04
 N    1.148600       1.006300       0.000000    
 N   -1.149900       1.009500      9.9999997E-05
 C    2.483000      0.4529000       0.000000    
 C   -2.481800      0.4514000       0.000000    
 C  -1.7000000E-03  0.2217000     -9.9999997E-05
 C    2.447500      -1.065900     -1.9999999E-04
 C   -2.440600      -1.067300     -1.9999999E-04
 H    2.999700      0.8318000     -0.8870000    
 H    2.999700      0.8316000      0.8870000    
 H   -3.000100      0.8282000      0.8870000    
 H   -3.000000      0.8283000     -0.8870000    
 H    1.049200       2.016600     -9.9999997E-05
 H   -1.051000       2.019800     -1.9999999E-04
 H    2.003100      -1.484700      0.9087000    
 H    2.002800      -1.484600     -0.9090000    
 H    3.484900      -1.424800     -3.9999999E-04
 H   -1.998300      -1.486000     -0.9102000    
 H   -1.998600      -1.486100      0.9099000    
 H   -3.477700      -1.427700     -3.9999999E-04


%chk=000012194-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000012194

0 1
O 0.000379 -1.144139 0.000936
N 1.164720 0.910802 0.000653
N -1.164831 0.909971 0.000612
C 2.580680 0.470992 -0.000232
C -2.580268 0.468605 -0.000345
C 0.000194 0.122708 0.001565
C 2.837323 -1.047935 -0.000423
C -2.834332 -1.050733 -0.000268
H 3.076805 0.910146 -0.891886
H 3.077890 0.910124 0.890830
H -3.078103 0.907208 0.890621
H -3.076851 0.906902 -0.892161
H 1.046210 1.925770 0.000442
H -1.047275 1.925058 0.000199
H 2.404692 -1.536800 0.885449
H 2.403512 -1.536768 -0.885742
H 3.933329 -1.203585 -0.001166
H -2.399510 -1.538951 -0.885447
H -2.400826 -1.538642 0.885723
H -3.930038 -1.208333 -0.001060


