%chk=000023669.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023669

0 1
 N  -0.7773000     -0.3713000      0.4526000    
 N    2.036500     -0.1188000      3.0500000E-02
 N   -4.968400      0.6348000      -1.145300    
 N   -5.358000     -0.2100000      0.9191000    
 N   -6.232500      0.2346000     -0.9486000    
 N   -6.508700     -0.2732000      0.2606000    
 C  -0.2379000      0.7675000     -0.3003000    
 C   4.7499999E-02  -1.562500      0.2153000    
 C    1.198000       1.079900      0.1279000    
 C    1.492400      -1.327600      0.6618000    
 C   -2.166500     -0.6257000      7.3200002E-02
 C    3.427400      1.1800000E-02 -5.0099999E-02
 C   -3.056400      0.5757000      0.4025000    
 C    4.091000       1.097200      0.5562000    
 C    4.206600     -0.9382000     -0.7403000    
 C   -4.492500      0.3309000      4.4000000E-02
 C    5.477400       1.227500      0.4752000    
 C    5.593000     -0.8079000     -0.8211000    
 C    6.228400      0.2751000     -0.2133000    
 H  -0.7957000       1.689200     -0.1167000    
 H  -0.2667000      0.5704000      -1.380400    
 H   3.2499999E-02  -1.839800     -0.8475000    
 H  -0.3505000      -2.413900      0.7807000    
 H    1.582900       1.874500     -0.5236000    
 H    1.203100       1.454900       1.159600    
 H    1.537300      -1.215800       1.752900    
 H    2.077800      -2.217600      0.4040000    
 H   -2.247200     -0.8726000     -0.9944000    
 H   -2.543100      -1.496300      0.6266000    
 H   -2.758000       1.478900     -0.1387000    
 H   -2.993700      0.8082000       1.473100    
 H    3.540700       1.852300       1.112100    
 H    3.732200      -1.783900      -1.233200    
 H    5.972800       2.069100      0.9507000    
 H    6.177800      -1.547900      -1.359600    
 H    7.307900      0.3765000     -0.2763000    
 H   -6.938800      0.3107000      -1.672800    


%chk=000023669-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000023669

0 1
N -0.789350 -0.318588 0.184637
N 2.098916 -0.116456 -0.016790
N -5.466130 1.141980 -0.383738
N -5.183250 -1.007651 0.379890
N -6.617517 0.399752 -0.432593
N -6.486391 -0.906578 0.019009
C -0.145324 0.859195 -0.444981
C 0.044469 -1.522315 -0.058509
C 1.266540 1.092978 0.123910
C 1.445781 -1.324849 0.539405
C -2.195441 -0.514566 -0.235324
C 3.512701 -0.000197 0.007462
C -3.139621 0.528335 0.415595
C 4.159261 1.252104 0.242818
C 4.345000 -1.134385 -0.247107
C -4.580626 0.233394 0.134563
C 5.566140 1.360442 0.207725
C 5.747826 -1.015180 -0.268511
C 6.377565 0.232666 -0.045073
H -0.751516 1.761507 -0.248510
H -0.070439 0.729374 -1.555373
H 0.141848 -1.742123 -1.152100
H -0.436325 -2.391129 0.427497
H 1.729409 1.918216 -0.444292
H 1.182655 1.407470 1.190504
H 1.348889 -1.232523 1.645434
H 2.056136 -2.215716 0.327323
H -2.312504 -0.479834 -1.348434
H -2.517742 -1.518916 0.093406
H -2.923826 1.549539 0.058113
H -2.955013 0.509244 1.505829
H 3.571778 2.144391 0.477624
H 3.897084 -2.109915 -0.461306
H 6.028712 2.336890 0.394783
H 6.354197 -1.905132 -0.474749
H 7.468697 0.320382 -0.066327
H -7.501289 0.774896 -0.775410


