%chk=000003655.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003655

0 1
 O    2.664100       1.587600      -1.054000    
 N  -0.3055000      -1.645600     -3.8300000E-02
 N  -5.2000000E-03   2.528100      0.2504000    
 C    2.404300       1.006900      0.2234000    
 C    3.532700      3.4699999E-02  0.5797000    
 C    3.415300      -1.250900     -0.2353000    
 C    1.054800      0.3444000      0.1567000    
 C    2.097800      -1.955700      7.8000002E-02
 C   0.9055000      -1.036400      4.5699999E-02
 C  -0.1095000       1.114800      0.1585000    
 C   -1.368600      0.5093000      6.6000000E-02
 C   -1.420700     -0.8931000     -3.2099999E-02
 C   -2.553100       1.265800      6.8400003E-02
 C   -2.671200      -1.498300     -0.1230000    
 C   -3.790900      0.6365000     -2.4400000E-02
 C   -3.849700     -0.7481000     -0.1199000    
 H    2.413000       1.803500      0.9760000    
 H    3.488100     -0.2121000       1.648100    
 H    4.508100      0.4961000      0.3867000    
 H    4.253200      -1.919300     -7.6000001E-03
 H    3.471500      -1.019600      -1.306400    
 H    2.152200      -2.398100       1.080500    
 H    1.949000      -2.776500     -0.6332000    
 H    3.517300       2.050800     -0.9978000    
 H   -2.566100       2.348200      0.1399000    
 H  -0.8173000       3.123900      0.2939000    
 H   0.8987000       2.977800      0.2127000    
 H   -2.743500      -2.581700     -0.1992000    
 H   -4.704500       1.223200     -2.2299999E-02
 H   -4.810800      -1.248700     -0.1926000    


%chk=000003655-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003655

0 1
O 2.686324 1.900972 -0.759305
N -0.307139 -1.688878 -0.008702
N 0.082795 2.552422 0.045503
C 2.416923 0.982822 0.407205
C 3.562340 -0.029463 0.600844
C 3.407819 -1.242629 -0.336782
C 1.064602 0.342589 0.167139
C 2.112373 -1.994054 0.028867
C 0.898399 -1.076141 0.066862
C -0.081078 1.177091 0.078956
C -1.391130 0.558607 0.035947
C -1.439806 -0.887437 0.011193
C -2.617233 1.296041 0.014341
C -2.717350 -1.535079 -0.021161
C -3.850848 0.637597 -0.014616
C -3.899746 -0.791170 -0.030991
H 2.347637 1.633364 1.308618
H 3.549627 -0.382166 1.652180
H 4.534847 0.481373 0.450150
H 4.278937 -1.917936 -0.246466
H 3.363613 -0.894585 -1.386876
H 2.227032 -2.474764 1.022672
H 1.895229 -2.810064 -0.682556
H 3.591951 2.288320 -0.642117
H -2.610681 2.393254 0.028140
H -0.721917 3.168813 -0.022351
H 0.998778 2.893143 -0.266199
H -2.721857 -2.629378 -0.039803
H -4.781671 1.215117 -0.027182
H -4.869770 -1.300282 -0.055011


