%chk=000006726.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006726

0 1
 N    1.113300      0.1035000     -4.1000000E-03
 N    3.998600      0.1906000     -0.1655000    
 C    1.812400       1.285700     -0.5222000    
 C    1.899100      -1.109600     -0.2611000    
 C  -0.2211000     -8.6000003E-03 -0.5896000    
 C    3.212200       1.403500      9.0599999E-02
 C    3.299300     -0.9925000      0.3507000    
 C   -1.092200       1.200900     -0.2841000    
 C  -0.9105000      -1.312300     -0.2151000    
 C    5.332200      0.3029000      0.4219000    
 C   -2.062300       1.571700      -1.193000    
 C  -0.7401000      -2.414900      -1.027500    
 C  -0.8861000       1.891700      0.8930000    
 C   -1.686100      -1.353500      0.9259000    
 C   -2.860600       2.680700     -0.9128000    
 C   -1.372300      -3.610000     -0.6841000    
 C   -1.684500       3.000700       1.173100    
 C   -2.318100      -2.548600       1.269300    
 C   -2.671900       3.395100      0.2702000    
 C   -2.161300      -3.676900      0.4644000    
 H    1.301900       2.227900     -0.3062000    
 H    1.906200       1.227800      -1.616100    
 H    1.990500      -1.309700      -1.337100    
 H    1.463300      -1.988000      0.2245000    
 H  -0.1026000     -1.8700000E-02  -1.685600    
 H    3.714000       2.269100     -0.3589000    
 H    3.128100       1.597300       1.168700    
 H    3.222300     -0.9536000       1.446000    
 H    3.865100      -1.897000      9.5500000E-02
 H    5.930400     -0.5852000      0.1898000    
 H    5.297400      0.4200000       1.511200    
 H    5.866900       1.161000     -9.9999997E-05
 H   -2.217900       1.020900      -2.115800    
 H  -0.1410000      -2.375000      -1.932100    
 H  -0.1472000       1.596400       1.631700    
 H   -1.816300     -0.5101000       1.593200    
 H   -3.629900       2.987400      -1.615400    
 H   -1.252600      -4.487800      -1.312400    
 H   -1.542300       3.553200       2.097400    
 H   -2.928100      -2.602700       2.166400    
 H   -3.294800       4.257400      0.4892000    
 H   -2.652900      -4.607600      0.7321000    


%chk=000006726-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000006726

0 1
N 1.183262 0.063061 -0.094847
N 4.087757 0.289428 0.010143
C 1.887653 1.296728 -0.543505
C 2.067465 -1.110628 -0.339233
C -0.159499 -0.091453 -0.730985
C 3.211195 1.464978 0.217830
C 3.391820 -0.951156 0.422833
C -1.052516 1.132198 -0.460919
C -0.875712 -1.359243 -0.233034
C 5.402208 0.442907 0.659621
C -1.850704 1.669875 -1.498559
C -1.618965 -2.153471 -1.138504
C -1.135191 1.706801 0.833037
C -0.853728 -1.723659 1.137400
C -2.722155 2.756057 -1.252442
C -2.335824 -3.285751 -0.687628
C -1.998840 2.794653 1.081157
C -1.562868 -2.856504 1.590198
C -2.799878 3.322381 0.040048
C -2.311183 -3.640934 0.680131
H 1.244535 2.172302 -0.354937
H 2.106010 1.255743 -1.640094
H 2.290293 -1.222446 -1.429936
H 1.558357 -2.027341 0.001841
H -0.055125 -0.185161 -1.844221
H 3.733557 2.366986 -0.153329
H 2.982851 1.621505 1.304366
H 3.175003 -0.955134 1.522910
H 4.046672 -1.815140 0.201705
H 6.038042 -0.429698 0.424047
H 5.338656 0.533469 1.774574
H 5.905478 1.347216 0.272110
H -1.790997 1.237399 -2.505434
H -1.638362 -1.885055 -2.202479
H -0.503839 1.303347 1.632329
H -0.261341 -1.120821 1.834624
H -3.333952 3.160686 -2.066801
H -2.907360 -3.890101 -1.401300
H -2.050408 3.231087 2.085406
H -1.534498 -3.128449 2.651756
H -3.472839 4.165322 0.233814
H -2.864530 -4.518882 1.032309


