%chk=000006824.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006824

0 1
 N   0.5387000     -0.3949000     -0.5143000    
 N  -0.2275000      -3.071300     -0.2451000    
 N    1.143800     -0.2449000      0.5701000    
 C   -1.766000      0.3251000     -0.1508000    
 C   -3.117200     -1.3200000E-02  0.1004000    
 C  -0.8114000     -0.6986000     -0.2644000    
 C   -1.183400      -2.036800     -0.1325000    
 C   -3.473700      -1.365400      0.2304000    
 C   -1.409500       1.677200     -0.2809000    
 C   -4.071900       1.010500      0.2138000    
 C   -2.512100      -2.369500      0.1143000    
 C   -2.371100       2.681400     -0.1654000    
 C   -3.699800       2.348600      8.1500001E-02
 C    2.493200      5.8400001E-02  0.3209000    
 C    2.888600       1.385600      0.1848000    
 C    3.423800     -0.9703000      0.2114000    
 C    4.227700       1.687000     -6.3400000E-02
 C    4.762900     -0.6688000     -3.6600001E-02
 C    5.164800      0.6599000     -0.1741000    
 H   -4.506300      -1.648500      0.4236000    
 H  -0.3851000       1.981600     -0.4804000    
 H   -5.116200      0.7737000      0.4064000    
 H   -2.815300      -3.408200      0.2194000    
 H   -2.082700       3.723400     -0.2697000    
 H   -4.448000       3.130800      0.1709000    
 H  -0.5103000      -4.037400     -0.1486000    
 H   0.7407000      -2.842300     -0.4267000    
 H    2.166100       2.192500      0.2712000    
 H    3.119700      -2.008000      0.3181000    
 H    4.540800       2.721500     -0.1700000    
 H    5.492700      -1.468500     -0.1225000    
 H    6.207500      0.8946000     -0.3671000    


%chk=000006824-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006824

0 1
N 0.550951 -0.640037 -0.358209
N -0.445528 -2.790174 -1.513134
N 1.182615 0.330397 0.273480
C -1.801225 0.242592 0.248638
C -3.219502 -0.033465 0.119954
C -0.849070 -0.702012 -0.325577
C -1.340015 -1.885580 -0.990123
C -3.656452 -1.224674 -0.558834
C -1.417852 1.443768 0.930757
C -4.180033 0.874212 0.663306
C -2.752606 -2.125946 -1.098558
C -2.384518 2.317295 1.452112
C -3.775381 2.039275 1.324391
C 2.605513 0.309810 0.107448
C 3.312317 -0.461748 -0.859868
C 3.329296 1.174837 0.973240
C 4.715482 -0.374079 -0.938863
C 4.734772 1.252412 0.892764
C 5.434910 0.477731 -0.062806
H -4.733543 -1.413568 -0.643249
H -0.352834 1.654913 1.035443
H -5.245925 0.640411 0.551664
H -3.100840 -3.030921 -1.609732
H -2.060887 3.228854 1.967672
H -4.517251 2.730492 1.738417
H -0.752720 -3.627266 -1.999447
H 0.545248 -2.564918 -1.401229
H 2.746557 -1.102088 -1.543582
H 2.765595 1.767602 1.701560
H 5.256182 -0.962304 -1.689573
H 5.283775 1.917036 1.569002
H 6.526469 0.542344 -0.132363


