%chk=000038287.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038287

0 1
 O   0.5319000      -1.511800      -1.115500    
 O    2.795000      -1.219500      -2.756100    
 O   -1.598600      0.4355000     -0.6654000    
 O   -4.043900       3.006900     -0.3331000    
 N    3.106000      0.1525000      0.6648000    
 C    3.108700       1.532100       1.162300    
 C    2.925600      0.1297000     -0.7769000    
 C    2.913400      -1.296300      -1.332700    
 C    3.311800       1.503600       2.680800    
 C    4.259500       2.290200      0.4921000    
 C    1.770200       2.198200      0.8221000    
 C    1.765500      -2.145600     -0.7913000    
 C  -0.5134000      -1.724700     -0.2570000    
 C   -1.516500     -0.7821000     -5.9099998E-02
 C   -2.592300     -0.9632000      0.8042000    
 C  -0.6162000      -2.913700      0.4656000    
 C   -3.367800      0.2221000      0.7081000    
 C   -2.680000      -2.167400       1.524300    
 C   -2.722700       1.035800     -0.1943000    
 C   -1.681200      -3.133900       1.342500    
 C   -3.036900       2.335700     -0.6808000    
 C   -2.118200       3.016000      -1.704600    
 H    2.354900     -0.3658000       1.118600    
 H    2.001300      0.6146000      -1.106600    
 H    3.743900      0.6392000      -1.296400    
 H    3.863100      -1.798200      -1.111400    
 H    4.257800       1.017900       2.947500    
 H    3.332600       2.517200       3.097000    
 H    2.503600      0.9581000       3.182000    
 H    4.064800       2.549500     -0.5540000    
 H    5.200800       1.730100      0.5443000    
 H    4.431800       3.244300       1.006300    
 H   0.9185000       1.571800       1.113700    
 H    1.669200       3.143200       1.370700    
 H    1.663600       2.457000     -0.2363000    
 H    1.897100      -2.288200      0.2876000    
 H    1.777500      -3.125400      -1.283800    
 H    3.569000     -0.7346000      -3.089800    
 H   0.1079000      -3.716100      0.3509000    
 H   -4.284100      0.4498000       1.235100    
 H   -3.502500      -2.353400       2.208300    
 H   -1.741300      -4.071800       1.888800    
 H   -1.118100       3.131600      -1.278100    
 H   -2.510600       4.005300      -1.957000    
 H   -2.073800       2.411100      -2.614200    


%chk=000038287-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038287

0 1
O 0.618214 -1.241667 -0.477771
O 2.767339 -1.647718 -2.657695
O -1.747206 0.376186 -0.281531
O -4.637723 2.589479 -0.116601
N 2.892518 0.518054 0.446399
C 3.376104 1.864249 0.898848
C 2.915460 0.211996 -1.000324
C 2.942194 -1.319372 -1.229376
C 3.085211 1.934939 2.417921
C 4.904405 1.970890 0.668937
C 2.644978 3.033989 0.173053
C 1.839169 -2.075420 -0.486744
C -0.537593 -1.792755 0.068116
C -1.678328 -0.960864 0.137178
C -2.931339 -1.388973 0.665166
C -0.691273 -3.107473 0.567014
C -3.814874 -0.248391 0.558256
C -3.068217 -2.717840 1.155186
C -3.088023 0.792154 -0.007091
C -1.939610 -3.552186 1.096826
C -3.460593 2.179191 -0.348279
C -2.389523 3.058945 -0.973929
H 1.942349 0.347103 0.808909
H 2.048411 0.621926 -1.562123
H 3.836465 0.637370 -1.443056
H 3.912112 -1.718427 -0.860688
H 3.601734 1.113114 2.944488
H 3.427644 2.897242 2.838354
H 1.999448 1.845368 2.617573
H 5.164440 1.966265 -0.406022
H 5.418996 1.122873 1.153912
H 5.291314 2.913781 1.096324
H 1.553401 2.979377 0.348866
H 3.004409 4.014187 0.538214
H 2.817660 2.996670 -0.918499
H 2.144069 -2.270617 0.559050
H 1.646762 -3.028359 -1.014586
H 3.390339 -1.098099 -3.197158
H 0.152381 -3.802777 0.549472
H -4.858954 -0.181387 0.856335
H -4.017121 -3.075509 1.564658
H -2.006786 -4.580818 1.466983
H -1.510940 3.137109 -0.307098
H -2.805468 4.059412 -1.165477
H -2.027054 2.614082 -1.918787


