%chk=000078722.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078722

0 1
 O  -0.2982000      -1.878900      0.3635000    
 O    2.009900     -0.3589000      0.1809000    
 N   0.7648000       1.569000     -0.1091000    
 N   -1.643000       1.474400     -0.1329000    
 N   -2.758700     -0.6020000      0.1441000    
 C  -0.3612000     -0.5397000      0.1723000    
 C   0.7783000      0.2332000      8.0200002E-02
 C   -1.555600      0.1415000      5.7200000E-02
 C  -0.4616000       2.116700     -0.2055000    
 C   0.3835000      -2.651900     -0.6277000    
 C    3.141800      0.4966000      7.7100001E-02
 H  -0.5022000       3.188300     -0.3579000    
 H   -3.626500     -8.6499996E-02  6.6699997E-02
 H   -2.754300      -1.462200      0.6782000    
 H  -0.1007000      -3.631400     -0.6815000    
 H    1.425500      -2.803100     -0.3323000    
 H   0.3301000      -2.187200      -1.618400    
 H    4.039600     -0.1206000      0.1770000    
 H    3.150800       1.236900      0.8841000    
 H    3.176700      0.9854000     -0.9024000    


%chk=000078722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078722

0 1
O -0.482717 -1.924870 0.214186
O 2.021643 -0.374862 0.075042
N 0.746770 1.622025 -0.084173
N -1.681731 1.555755 -0.025348
N -2.811539 -0.507106 0.173307
C -0.386405 -0.529711 0.071134
C 0.786280 0.261205 0.018408
C -1.628391 0.183235 0.068684
C -0.487841 2.196168 -0.106835
C 0.429812 -2.770278 -0.587363
C 3.214338 0.501094 0.044410
H -0.520651 3.286117 -0.194109
H -3.683620 0.015484 0.176163
H -2.792157 -1.518687 0.276189
H 0.149763 -3.804433 -0.335554
H 1.479126 -2.569446 -0.320554
H 0.273798 -2.586141 -1.667455
H 4.061883 -0.196643 0.116512
H 3.200631 1.202095 0.895172
H 3.250012 1.078600 -0.894215


