%chk=000072263.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072263

0 1
 O   -1.453400      0.2443000      -1.075000    
 O   -2.689300       2.248100      0.3577000    
 O    1.299300      -2.754900     -0.3642000    
 O    4.466400      0.5113000      0.3073000    
 N   0.5780000     -0.5395000     -0.2177000    
 N    2.868200      -1.115900     -2.8700000E-02
 C  -0.8105000     -0.8448000     -0.3986000    
 C   -1.554000     -0.9979000      0.9154000    
 C   -2.861300      0.1517000     -0.7714000    
 C   -2.939800     -0.6593000      0.4866000    
 C   -3.416600       1.560700     -0.6455000    
 C   0.9448000      0.7878000     -4.3400001E-02
 C    1.553700      -1.557800     -0.2153000    
 C   -4.059000      -1.076200       1.087700    
 C    2.203600       1.207300      0.1350000    
 C    3.290800      0.1928000      0.1491000    
 C    2.579000       2.642300      0.3210000    
 H  -0.9180000      -1.745500      -1.017500    
 H   -1.218400     -0.2668000       1.660300    
 H   -1.446400      -2.003100       1.333500    
 H   -3.344900     -0.3810000      -1.598400    
 H   -4.479100       1.558600     -0.3832000    
 H   -3.279900       2.105900      -1.585100    
 H   0.1454000       1.521100     -3.2099999E-02
 H   -5.035900     -0.8152000      0.6958000    
 H   -4.018300      -1.687400       1.982700    
 H    3.589600      -1.831700     -2.3499999E-02
 H    3.072300       2.786300       1.287800    
 H    1.704800       3.301500      0.2926000    
 H    3.263500       2.964200     -0.4705000    
 H   -3.055400       3.147200      0.4121000    


%chk=000072263-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072263

0 1
O -1.525405 -0.294093 -1.293717
O -2.147126 2.068771 0.365845
O 1.420160 -2.784349 -0.594917
O 4.441745 0.721176 0.055280
N 0.558738 -0.626424 -0.154254
N 2.883924 -0.986564 -0.267061
C -0.828601 -1.110775 -0.265540
C -1.669858 -0.981812 1.030441
C -2.885469 0.063794 -0.815767
C -3.060757 -0.673302 0.511642
C -3.011379 1.591741 -0.727675
C 0.803244 0.729679 0.095337
C 1.607753 -1.557401 -0.362428
C -4.245066 -1.014977 1.065725
C 2.068239 1.261293 0.183912
C 3.225366 0.373517 -0.001602
C 2.335685 2.722272 0.450460
H -0.757071 -2.154705 -0.613634
H -1.302056 -0.130989 1.633760
H -1.621254 -1.898081 1.639583
H -3.613640 -0.290160 -1.571348
H -4.073387 1.849852 -0.532210
H -2.696018 2.029975 -1.696404
H -0.101214 1.342519 0.191081
H -5.199952 -0.757498 0.592134
H -4.299547 -1.558957 2.014667
H 3.666764 -1.633396 -0.406452
H 2.949452 2.848972 1.360861
H 1.394640 3.284904 0.574844
H 2.912781 3.172853 -0.377575
H -2.251490 3.046265 0.469512


