%chk=000157312.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157312

0 1
 O    2.028100      -1.219700     -0.6666000    
 O    1.022300      -1.947900       1.258700    
 N   -1.066600     -0.1091000      0.5288000    
 C   0.3323000      0.1562000      0.2195000    
 C   0.5521000      0.4886000      -1.247700    
 C    1.931700     -6.6000000E-02  -1.510700    
 C    1.123300      -1.124600      0.3611000    
 C   -1.615200      -1.113200     -0.3846000    
 C   -1.852900       1.123900      0.4590000    
 C   0.9222000       1.154400       1.165500    
 C   -3.064300      -1.425000     -5.1399998E-02
 C   -1.759200       1.757500     -0.9187000    
 C    1.446400       2.325000      0.7871000    
 H   0.5681000       1.524300      -1.581300    
 H  -6.2500000E-02 -4.9800001E-02  -1.968600    
 H    2.061600     -0.3712000      -2.553700    
 H    2.737300      0.6272000      -1.248400    
 H   -1.614600     -0.8943000      -1.452000    
 H   -1.078000      -2.061700     -0.2700000    
 H   -2.900600      0.9456000      0.7236000    
 H   -1.533700       1.847100       1.219500    
 H   0.9122000      0.9181000       2.227900    
 H   -3.210300      -1.583300       1.022800    
 H   -3.753200     -0.6470000     -0.3950000    
 H   -3.365600      -2.350600     -0.5558000    
 H  -0.9598000       2.495900     -0.9957000    
 H   -1.835100       1.109100      -1.790800    
 H   -2.656200       2.388800      -1.016300    
 H    1.845500       2.988800       1.549300    
 H    1.516800       2.687300     -0.2277000    


%chk=000157312-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157312

0 1
O 2.161845 -1.305542 -0.517740
O 0.859732 -1.932417 1.290211
N -1.118390 0.027910 0.221897
C 0.334953 0.217133 0.044127
C 0.853864 0.529933 -1.400013
C 2.234502 -0.151282 -1.471057
C 1.092457 -1.127992 0.377837
C -1.728184 -1.097910 -0.525600
C -1.943612 1.255596 0.324536
C 0.858514 1.173220 1.121462
C -3.027306 -1.612012 0.125535
C -2.284874 1.984483 -1.004104
C 1.663561 2.250313 0.952373
H 0.911742 1.609443 -1.613168
H 0.163277 0.074077 -2.130689
H 2.481078 -0.579723 -2.454791
H 3.054419 0.502357 -1.126840
H -1.932679 -0.844263 -1.595125
H -1.002653 -1.930708 -0.530542
H -2.885708 0.983633 0.835425
H -1.421235 1.959884 0.996397
H 0.535588 0.879991 2.130788
H -2.841932 -1.865418 1.183385
H -3.845235 -0.870589 0.079019
H -3.373973 -2.521212 -0.399061
H -1.375840 2.350912 -1.513451
H -2.832611 1.327285 -1.704352
H -2.929279 2.859011 -0.794963
H 1.995646 2.837793 1.815223
H 2.014433 2.590495 -0.028918


