%chk=000059687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059687

0 1
 O   -1.248400      9.2900001E-02  0.9702000    
 O    3.776800       1.390900     -0.9909000    
 N    2.547900     -0.5672000     -0.7014000    
 C   0.7520000       1.363600      0.7787000    
 C    1.486100       1.597800     -0.4973000    
 C    1.519000       2.636500      0.5712000    
 C  -0.7313000       1.402100      0.7631000    
 C    2.725500      0.8069000     -0.7556000    
 C    3.607800      -1.511800     -0.9210000    
 C   -2.465600     -0.1857000      0.4067000    
 C    4.335400      -1.877800      0.3671000    
 C   -3.396200      0.8335000      0.2390000    
 C   -2.758300      -1.485300      8.5000005E-03
 C    3.419800      -2.525200       1.396300    
 C   -4.635800      0.5496000     -0.3340000    
 C   -3.998000      -1.769200     -0.5646000    
 C   -4.936600     -0.7517000     -0.7359000    
 H    1.149400      0.6839000       1.522900    
 H   0.9210000       1.844800      -1.390000    
 H   0.9654000       3.552600      0.4023000    
 H    2.428700       2.772100       1.144300    
 H   -1.074300       1.833000     -0.1865000    
 H   -1.078600       2.040700       1.584100    
 H    1.622400     -0.9353000     -0.5006000    
 H    3.162800      -2.403000      -1.376200    
 H    4.320300      -1.088300      -1.637300    
 H    5.151700      -2.570000      0.1307000    
 H    4.788900     -0.9824000      0.8084000    
 H   -3.215000       1.852700      0.5664000    
 H   -2.030000      -2.280500      0.1400000    
 H    2.636700      -1.835600       1.726700    
 H    3.996400      -2.822100       2.278200    
 H    2.941300      -3.420800      0.9873000    
 H   -5.370000       1.339900     -0.4609000    
 H   -4.232500      -2.782600     -0.8773000    
 H   -5.902400     -0.9731000      -1.180500    


%chk=000059687-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059687

0 1
O -1.209499 0.357203 0.544950
O 3.542582 1.153366 1.033027
N 3.294568 -0.320391 -0.754685
C 0.642346 1.893456 0.646764
C 1.636696 1.448629 -0.451551
C 1.468798 2.938978 -0.097302
C -0.838283 1.779366 0.387634
C 2.894264 0.764261 0.008576
C 4.469500 -1.134576 -0.394389
C -2.566817 0.019221 0.406730
C 4.133423 -2.310332 0.556104
C -3.594717 0.938812 0.076864
C -2.874319 -1.349183 0.617685
C 3.160011 -3.339878 -0.055110
C -4.926556 0.475178 -0.039990
C -4.205038 -1.793982 0.497031
C -5.241564 -0.885193 0.166910
H 0.964699 1.665419 1.667644
H 1.195339 1.102107 -1.393025
H 0.973963 3.580239 -0.833485
H 2.299015 3.392164 0.450166
H -1.093210 2.119619 -0.638640
H -1.410980 2.390436 1.115849
H 2.701649 -0.624699 -1.527747
H 4.928131 -1.516340 -1.326939
H 5.189940 -0.458617 0.098362
H 5.084738 -2.808836 0.829509
H 3.711330 -1.892851 1.489244
H -3.377961 1.998273 -0.088591
H -2.061531 -2.035142 0.876206
H 2.184321 -2.875320 -0.290750
H 2.968584 -4.170446 0.647903
H 3.568730 -3.776468 -0.987073
H -5.719241 1.188174 -0.294172
H -4.435324 -2.852377 0.663196
H -6.275289 -1.234369 0.075199


