%chk=000027347.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027347

0 1
 O   -1.743300      -2.223000      2.5000000E-02
 N    3.161500     -2.5300000E-02  0.1724000    
 N  -0.3100000     -7.8299999E-02 -0.8660000    
 C    2.692900     -0.5313000      -1.112000    
 C    1.863700      0.5100000      -1.869300    
 C    4.002100       1.158500     -1.5400000E-02
 C    3.899300      -1.061700      0.8969000    
 C   0.6178000      0.9869000      -1.125400    
 C    4.446200       1.739800       1.310900    
 C    3.053900      -2.300900       1.106600    
 C   -1.531900      0.1186000     -0.2750000    
 C   -2.319900      -1.140500     -8.6700000E-02
 C   -1.949000       1.337300      0.1061000    
 C   -3.801000      -1.131000     -0.1637000    
 C   -3.138200       1.722300      0.8195000    
 C   -4.636500     -0.1597000      0.2140000    
 C   -4.307800       1.078700      0.8622000    
 H    3.536600     -0.8382000      -1.744700    
 H    2.056300      -1.412800     -0.9938000    
 H    2.467300       1.367800      -2.183500    
 H    1.539300      4.1700002E-02  -2.809400    
 H    4.879100      0.9426000     -0.6386000    
 H    3.444700       1.963400     -0.5028000    
 H    4.830800      -1.334300      0.3847000    
 H    4.164700     -0.7117000       1.899900    
 H   0.9130000       1.477100     -0.1903000    
 H   0.1412000       1.746300      -1.758500    
 H  -8.6800002E-02  -1.022800      -1.161800    
 H    3.607700       1.852500       2.006700    
 H    5.227800       1.142400       1.790400    
 H    4.872300       2.737000       1.151600    
 H    2.052900      -2.055100       1.478000    
 H    2.959900      -2.904400      0.1984000    
 H    3.527900      -2.945100       1.856200    
 H   -1.310200       2.203000     -6.1000001E-02
 H   -4.233300      -2.052700     -0.5483000    
 H   -3.061100       2.666900       1.355000    
 H   -5.704000     -0.3392000      9.9200003E-02
 H   -5.119400       1.528700       1.430100    


%chk=000027347-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027347

0 1
O -1.646132 -1.993308 -1.656582
N 3.232174 0.050310 0.045529
N -0.293201 0.132083 -1.297033
C 2.752533 -0.407771 -1.284277
C 1.993034 0.702716 -2.051093
C 4.506251 0.816238 -0.041504
C 3.282648 -1.044019 1.055820
C 0.731610 1.180076 -1.306632
C 4.695883 1.806145 1.124202
C 1.891294 -1.448245 1.579223
C -1.448510 0.118054 -0.570376
C -2.204603 -1.164906 -0.825916
C -1.806794 1.194728 0.275241
C -3.465872 -1.485637 -0.203708
C -2.945839 1.356866 1.101092
C -4.253052 -0.775286 0.711123
C -4.039256 0.497922 1.308164
H 3.592221 -0.781348 -1.920713
H 2.073580 -1.266015 -1.131797
H 2.656153 1.575802 -2.199008
H 1.725186 0.333727 -3.062252
H 5.388288 0.129310 -0.102817
H 4.493447 1.388178 -0.988320
H 3.811976 -1.943851 0.651228
H 3.887190 -0.684472 1.908385
H 1.028274 1.426538 -0.266978
H 0.329206 2.101466 -1.778533
H -0.198520 -0.721631 -1.878872
H 3.854289 2.519971 1.157431
H 4.740896 1.290412 2.100256
H 5.638134 2.372385 1.001755
H 1.384405 -0.576003 2.028127
H 1.239719 -1.841835 0.778387
H 1.985346 -2.236986 2.348893
H -1.098829 2.033093 0.295635
H -3.841676 -2.466268 -0.525244
H -2.972294 2.302398 1.661537
H -5.180062 -1.283715 1.012932
H -4.812597 0.846378 2.004297


