%chk=000002054.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002054

0 1
 O   -3.231600      2.0199999E-02  -1.999900    
 O   -4.404300      0.3122000      0.5033000    
 O    4.324800      0.5137000     -0.1615000    
 O    3.758800      -1.686100     -0.1307000    
 N    1.566500       2.551800      5.4800000E-02
 C  -0.3641000     -0.5896000      0.1837000    
 C   -1.133300     -0.4333000     -0.9694000    
 C  -0.9527000     -0.4428000       1.439800    
 C   -2.490900     -0.1302000     -0.8664000    
 C   -3.079400      1.6600000E-02  0.3896000    
 C   -2.310300     -0.1396000       1.542800    
 C    1.051500     -0.9056000      7.6499999E-02
 C    2.046000      9.4999997E-03  5.7999999E-03
 C    3.437300     -0.5082000     -0.1009000    
 C    1.781600       1.411600      3.2400001E-02
 H  -0.6830000     -0.5464000      -1.953400    
 H  -0.3667000     -0.5620000       2.348000    
 H   -2.756000     -2.8000001E-02   2.527600    
 H    1.268600      -1.971100      5.5199999E-02
 H   -4.146800      0.2269000      -1.741900    
 H   -4.634900      0.3755000       1.446000    
 H    5.249300      0.1932000     -0.2319000    


%chk=000002054-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000002054

0 1
O -3.600625 -1.264246 -1.673656
O -4.564816 0.100418 0.449651
O 4.568608 0.066312 0.383219
O 3.624078 -1.074330 -1.411550
N 2.221826 1.404936 2.470703
C -0.379233 -0.227830 -0.088410
C -1.319768 -0.814981 -0.992965
C -0.871795 0.498751 1.040117
C -2.698206 -0.684979 -0.782538
C -3.165431 0.042743 0.348647
C -2.256009 0.630421 1.252434
C 1.029923 -0.424870 -0.398796
C 2.181061 -0.008625 0.252448
C 3.483678 -0.404131 -0.359628
C 2.208338 0.761055 1.460961
H -0.978021 -1.377026 -1.868223
H -0.182469 0.959930 1.749502
H -2.624361 1.190301 2.120733
H 1.235905 -1.008969 -1.308353
H -4.528501 -1.074174 -1.374743
H -4.868903 0.614484 1.235967
H 5.415119 -0.216891 -0.056019


