%chk=000092910.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092910

0 1
 O   -1.016200      0.6528000       1.576400    
 O    1.199500      0.3290000      -1.702400    
 O    2.332900       2.517200      0.9703000    
 N   -3.432200       1.412700      0.9895000    
 N  -0.8174000     -0.7952000     -0.2364000    
 N    2.614600     -3.1199999E-02  0.1031000    
 N    4.305000       3.200200      5.5000000E-03
 C   -2.849900      0.4335000      7.1599998E-02
 C   -2.842800       1.095800      -1.303100    
 C   -3.468400       2.464300      -1.077700    
 C   -4.289000       2.273800      0.1804000    
 C   0.5270000      -1.246100      1.4200000E-02
 C   0.7791000      -2.655200     -0.5372000    
 C   -1.477300      0.1203000      0.5702000    
 C  -0.1513000      -3.747400      2.8700000E-02
 C    1.467400     -0.2443000     -0.6485000    
 C   0.1096000      -5.117500     -0.5985000    
 C   1.9500000E-02  -3.834600       1.547900    
 C    3.646400      0.9078000     -0.2741000    
 C    3.343400       2.264100      0.3200000    
 H   -3.448800     -0.4846000      6.4300001E-02
 H   -1.851400       1.198700      -1.756100    
 H   -3.470000      0.5180000      -1.992600    
 H   -2.682300       3.211600     -0.9129000    
 H   -4.074000       2.788300      -1.929100    
 H   -5.237500       1.769100     -3.5399999E-02
 H   -4.507700       3.220700      0.6823000    
 H   -2.691800       1.995500       1.383600    
 H   0.6989000      -1.219000       1.095900    
 H    1.825400      -2.932900     -0.3514000    
 H   0.6656000      -2.637900      -1.630100    
 H   -1.193600      -3.482000     -0.1866000    
 H   -1.278700      -1.128100      -1.078500    
 H  -2.8300000E-02  -5.076800      -1.684000    
 H  -0.5811000      -5.868300     -0.2008000    
 H    1.132200      -5.456000     -0.3997000    
 H    1.068000      -3.989200       1.824800    
 H  -0.3407000      -2.930900       2.048300    
 H  -0.5603000      -4.671200       1.953500    
 H    2.745000     -0.5445000      0.9699000    
 H    3.698100      0.9874000      -1.364500    
 H    4.599200      0.5386000      0.1165000    
 H    5.125600       2.970800     -0.5462000    
 H    4.224000       4.159500      0.3259000    


%chk=000092910-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092910

0 1
O -2.071878 -0.461588 1.219589
O 1.300107 0.567329 -2.071902
O 4.817657 0.682471 1.347423
N -4.472363 -0.084776 -0.115376
N -0.840522 -0.428546 -0.756738
N 2.661972 0.415731 -0.202355
N 6.039685 1.886878 -0.220682
C -3.220340 0.201712 -0.863248
C -3.191632 1.764925 -1.126543
C -4.273172 2.325814 -0.167504
C -5.294790 1.157207 -0.111606
C 0.462318 -0.714557 -0.141887
C 0.868226 -2.217259 -0.261907
C -2.001587 -0.263696 -0.037937
C -0.041536 -3.204814 0.514504
C 1.502378 0.153651 -0.881717
C 0.331133 -4.656957 0.129916
C 0.050550 -2.996716 2.044797
C 3.758510 1.158133 -0.813787
C 4.913330 1.217573 0.202237
H -3.205976 -0.331701 -1.834897
H -2.192920 2.201863 -0.952067
H -3.469376 1.966638 -2.177544
H -3.846255 2.498969 0.837603
H -4.712365 3.271784 -0.531686
H -5.947740 1.182164 -1.006617
H -5.945192 1.180417 0.780253
H -4.218689 -0.378298 0.843226
H 0.399639 -0.433561 0.925772
H 1.910674 -2.331584 0.102341
H 0.871873 -2.481744 -1.338731
H -1.090299 -3.021239 0.206241
H -0.796621 -0.159357 -1.747476
H 0.230565 -4.827122 -0.958708
H -0.323356 -5.381158 0.648947
H 1.377033 -4.885117 0.414658
H 1.098247 -3.090539 2.393594
H -0.345202 -2.009320 2.339079
H -0.549646 -3.759179 2.574829
H 2.831426 0.102699 0.762729
H 3.434790 2.181197 -1.090963
H 4.088591 0.667863 -1.750903
H 6.104932 2.313379 -1.143684
H 6.833520 1.957232 0.415728


