%chk=000015451.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015451

0 1
 O   -4.366700      3.8500000E-02  0.4469000    
 O   -3.154400       1.840600      0.1282000    
 N  -0.4039000       1.599400     -0.3348000    
 N    3.514600     -0.1396000      0.4876000    
 N   -3.266700      0.5960000      0.2233000    
 C    1.405700      0.3365000     -0.5742000    
 C   0.2955000     -0.5190000     -0.3279000    
 C    2.805300     -8.0799997E-02 -0.7933000    
 C  -0.8273000      0.2985000     -0.1816000    
 C   0.9440000       1.632600     -0.5721000    
 C   -2.105200     -0.2122000      7.2600000E-02
 C   0.1376000      -1.914600     -0.2153000    
 C   -2.237500      -1.599500      0.1803000    
 C   -1.134700      -2.439500      3.8800001E-02
 C    3.509300       1.172100       1.132100    
 C    4.884400     -0.6088000      0.2893000    
 H    2.818100      -1.068400      -1.271700    
 H    3.300700      0.6077000      -1.491600    
 H    1.448900       2.576800     -0.7225000    
 H   -1.000500       2.413300     -0.2809000    
 H   0.9864000      -2.584200     -0.3215000    
 H   -3.198400      -2.070600      0.3766000    
 H   -1.261700      -3.515400      0.1268000    
 H    4.176600       1.165800       2.003300    
 H    2.528600       1.429100       1.543600    
 H    3.853600       1.973200      0.4675000    
 H    5.465800      6.7100003E-02 -0.3484000    
 H    4.888600      -1.604100     -0.1691000    
 H    5.401900     -0.7068000       1.250100    


%chk=000015451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015451

0 1
O -4.456047 -0.130183 0.353871
O -3.351406 1.716665 -0.415578
N -0.647331 1.697180 -0.780275
N 3.471096 -0.299246 0.291798
N -3.372256 0.476104 0.003584
C 1.388345 0.651257 -0.707585
C 0.365469 -0.278785 -0.251349
C 2.855943 0.358556 -0.892074
C -0.895936 0.418310 -0.313909
C 0.729606 1.840069 -1.015501
C -2.098772 -0.228620 0.068515
C 0.399415 -1.616222 0.210119
C -2.049643 -1.568747 0.517019
C -0.810417 -2.248877 0.585682
C 3.455582 0.559609 1.494414
C 4.825069 -0.806980 -0.010306
H 2.990910 -0.334403 -1.747405
H 3.387925 1.307839 -1.165346
H 1.137058 2.777399 -1.389178
H -1.397114 2.380100 -0.906352
H 1.362506 -2.129756 0.287918
H -2.984637 -2.055051 0.808887
H -0.793294 -3.283460 0.942657
H 3.846371 -0.007936 2.357502
H 2.420496 0.865063 1.722769
H 4.073555 1.486128 1.376973
H 5.557613 0.001727 -0.263023
H 4.781146 -1.506483 -0.864766
H 5.217347 -1.357554 0.863042


