%chk=000053147.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053147

0 1
 O   -1.617000     -0.5578000     -0.6664000    
 O   -3.005500     -0.6893000     -0.2517000    
 O    1.942800       1.543400     -0.3416000    
 N   0.5532000      6.8400003E-02  0.2425000    
 N   0.8894000      0.9754000     -0.6540000    
 C  -0.9100000     -3.2299999E-02  0.4676000    
 C    1.106500      -1.266500     -3.6300000E-02
 C   -1.513200       1.327700      0.8418000    
 C    2.553900      -1.369100      0.3981000    
 H   -1.076900     -0.7084000       1.317200    
 H   0.5616000      -2.028200      0.5375000    
 H    1.000400      -1.543800      -1.093900    
 H  -0.9329000       1.817100       1.631800    
 H   -1.577100       1.998100     -2.2700001E-02
 H   -2.534800       1.213500       1.220800    
 H    3.211600     -0.7396000     -0.2094000    
 H    2.676700      -1.084900       1.448900    
 H    2.903700      -2.401600      0.2918000    
 H   -2.960800      -1.640900     -5.6400001E-02


%chk=000053147-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000053147

0 1
O -1.717466 -0.757531 -0.480344
O -2.845976 -1.350950 0.377696
O 1.912346 1.207906 -1.423490
N 0.458150 0.010751 -0.197994
N 0.797771 1.229464 -0.790293
C -0.818484 -0.045353 0.501901
C 1.289665 -1.209819 -0.349559
C -1.400532 1.305273 0.914239
C 2.349628 -1.339300 0.764817
H -0.718467 -0.723591 1.370781
H 0.600647 -2.070739 -0.360499
H 1.784016 -1.138776 -1.334514
H -0.728436 1.824051 1.619227
H -1.554767 1.955341 0.040411
H -2.365713 1.120973 1.415343
H 3.048635 -0.486413 0.740602
H 1.882545 -1.385590 1.765346
H 2.930709 -2.267231 0.617758
H -3.632669 -0.997266 -0.125826


