%chk=000058294.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058294

0 1
 O   -5.655600     -0.4341000      0.8072000    
 O   -5.445600       1.496600     -0.2254000    
 N   0.4864000     -0.4468000     -0.5136000    
 N    3.275900     -0.4307000      0.1656000    
 N    5.426400      0.6452000      0.2765000    
 N   -1.435700      0.9313000     -0.8039000    
 N   -4.958800      0.4268000      0.2161000    
 C    1.169100      -1.632900     -5.3199999E-02
 C    2.634900      -1.588000     -0.4524000    
 C  -0.8693000     -0.2221000     -0.3362000    
 C   -1.624800      -1.197400      0.3266000    
 C    4.527400     -0.3241000     -0.1314000    
 C   -2.986400     -0.9858000      0.5130000    
 C   -3.573600      0.1831000      4.1600000E-02
 C   -2.761900       1.101800     -0.6043000    
 C    6.816100      0.6114000     -0.1565000    
 C    4.975300       1.865800      0.9302000    
 H    1.098200      -1.710100       1.038700    
 H   0.7223000      -2.530000     -0.4978000    
 H    3.120900      -2.514200     -0.1215000    
 H    2.716600      -1.528900      -1.545500    
 H    1.011200      0.2767000     -0.9919000    
 H   -1.199400      -2.119300      0.7085000    
 H    5.015800      -1.077700     -0.7763000    
 H   -3.560800      -1.750500       1.029200    
 H   -3.142400       2.038100      -1.001300    
 H    7.469800       1.114200      0.5639000    
 H    6.919100       1.108100      -1.126400    
 H    7.173300     -0.4193000     -0.2538000    
 H    4.189500       1.651100       1.661900    
 H    4.578800       2.564600      0.1868000    
 H    5.791900       2.359800       1.467000    


%chk=000058294-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058294

0 1
O -5.604658 -0.221408 0.908277
O -5.095934 1.927095 0.303672
N 0.605192 -0.602575 -0.358830
N 3.296330 -0.475557 -0.616520
N 5.233324 0.737551 0.018294
N -1.120551 0.950024 -0.322737
N -4.765006 0.689946 0.516746
C 1.316519 -1.863844 -0.146610
C 2.674587 -1.782192 -0.889377
C -0.716044 -0.361325 -0.115046
C -1.631474 -1.380860 0.322716
C 4.543146 -0.435451 -0.214954
C -2.970503 -1.040508 0.529908
C -3.377489 0.300574 0.306213
C -2.417755 1.258135 -0.114890
C 6.584397 0.726162 0.588385
C 4.589819 2.043381 -0.181459
H 1.490736 -2.040312 0.936358
H 0.728801 -2.715081 -0.540828
H 3.300361 -2.654463 -0.589202
H 2.483100 -1.863932 -1.978217
H 1.217104 0.198744 -0.568969
H -1.287691 -2.403181 0.499538
H 5.154331 -1.344295 -0.037753
H -3.708869 -1.774939 0.862704
H -2.720671 2.296162 -0.281879
H 6.597869 1.157892 1.609617
H 7.280140 1.313534 -0.041749
H 6.962505 -0.308759 0.647673
H 3.687414 1.899255 -0.794691
H 5.284518 2.731712 -0.697854
H 4.291052 2.501215 0.782862


