%chk=000026632.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026632

0 1
 O  -0.2176000      -1.285600       1.984900    
 O  -0.8004000       1.131400      -1.998700    
 O    2.638100       2.129300      0.8712000    
 N    1.266300      0.3555000       1.378300    
 N   0.9747000       1.563200     -0.6113000    
 N   -2.527300       1.344600      6.8999999E-03
 C  -0.2640000     -0.5346000     -0.3203000    
 C   -1.740500     -0.9549000     -0.3592000    
 C   0.5812000      -1.575700      -1.075900    
 C   -2.630600     -2.1800000E-02  0.4630000    
 C   0.2256000     -0.5253000       1.124400    
 C  -9.2799999E-02  0.7941000      -1.049900    
 C   -4.084100     -0.4788000      0.3965000    
 C    2.035300      -1.257500     -0.9664000    
 C    1.703000       1.390000      0.5596000    
 C    2.933000      -2.073900     -0.4032000    
 H   -2.098600     -0.9963000      -1.397600    
 H   -1.848900      -1.975500      3.3500001E-02
 H   0.3094000      -1.596000      -2.139200    
 H   0.3822000      -2.581600     -0.6828000    
 H   -2.347600     -4.8000000E-02   1.520200    
 H   -4.728000      0.1693000       1.001800    
 H   -4.464700     -0.4654000     -0.6311000    
 H   -4.188200      -1.499400      0.7807000    
 H    1.705300      0.2882000       2.292400    
 H    1.198500       2.386300      -1.163700    
 H    2.419400     -0.3832000      -1.483700    
 H   -2.577500       1.406800      -1.007200    
 H   -1.668300       1.786400      0.3214000    
 H    3.987300      -1.819700     -0.4108000    
 H    2.636700      -3.000400      7.5999998E-02


%chk=000026632-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026632

0 1
O 0.029984 -1.384817 1.997892
O -0.430809 0.797263 -2.317074
O 2.187815 2.618730 1.056630
N 1.095697 0.596191 1.475446
N 0.943342 1.615245 -0.647829
N -2.217496 1.373411 0.165034
C -0.180792 -0.608440 -0.318215
C -1.690967 -0.986449 -0.353691
C 0.633172 -1.789563 -1.001332
C -2.589273 -0.032985 0.469532
C 0.297683 -0.505779 1.134878
C 0.044808 0.659473 -1.155730
C -4.085113 -0.358857 0.234368
C 2.121544 -1.545267 -1.133871
C 1.460674 1.675767 0.651782
C 3.074602 -2.242220 -0.465987
H -2.004325 -0.978318 -1.415745
H -1.810558 -2.014232 0.032731
H 0.181800 -1.932191 -2.002539
H 0.446522 -2.697972 -0.400895
H -2.360620 -0.190584 1.541114
H -4.731306 0.286041 0.857777
H -4.356666 -0.195849 -0.826421
H -4.311483 -1.411973 0.486378
H 1.459343 0.628771 2.433329
H 1.148931 2.421711 -1.245670
H 2.427856 -0.760114 -1.841438
H -2.559982 2.049296 0.857507
H -2.462185 1.660582 -0.791889
H 4.141385 -2.036393 -0.608104
H 2.813314 -3.038979 0.241832


