%chk=000125542.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125542

0 1
 O   0.7507000     -0.1854000      0.5202000    
 O    2.399400       2.082200       1.051700    
 O    2.444500      -2.299500     -0.3779000    
 O   0.4538000      0.5934000      -1.626600    
 N    2.112400     -0.1008000      0.3028000    
 N   -5.536000     -0.2043000      0.4982000    
 C    4.236300      0.7633000      0.1885000    
 C    4.251300     -0.6914000     -0.2863000    
 C    2.809200       1.031400      0.5834000    
 C    2.831800      -1.167300     -0.1339000    
 C   -1.451400      9.4400004E-02 -0.2832000    
 C   3.4000000E-03  0.2012000     -0.5609000    
 C   -2.316100      0.9654000     -0.9132000    
 C   -1.892900     -0.8724000      0.5967000    
 C   -4.154400     -0.1034000      0.2339000    
 C   -3.682500      0.8656000     -0.6517000    
 C   -3.259500     -0.9724000      0.8583000    
 H    4.533400       1.446000     -0.6130000    
 H    4.893000      0.9058000       1.051600    
 H    4.915700      -1.303200      0.3306000    
 H    4.556100     -0.7642000      -1.334300    
 H   -1.960500       1.726100      -1.601800    
 H   -1.217100      -1.568100       1.084900    
 H   -4.369800       1.549200      -1.143700    
 H   -3.615200      -1.733300       1.548400    
 H   -5.878600     -0.9071000       1.139700    
 H   -6.185400      0.4249000      4.5299999E-02


%chk=000125542-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125542

0 1
O 0.779711 -0.348766 0.557437
O 2.452210 1.822416 1.505276
O 2.396464 -2.147572 -1.038949
O 0.527291 0.942884 -1.418747
N 2.166591 -0.211106 0.314440
N -5.618339 -0.254193 0.443987
C 4.348064 0.670906 0.329374
C 4.331106 -0.639938 -0.502833
C 2.910462 0.892115 0.813665
C 2.882450 -1.140931 -0.487211
C -1.452048 0.159557 -0.205941
C -0.026201 0.336010 -0.486111
C -2.387729 0.762925 -1.094886
C -1.938756 -0.585256 0.906165
C -4.254900 -0.117899 0.231070
C -3.764410 0.630271 -0.884841
C -3.315100 -0.723279 1.122853
H 4.653106 1.549946 -0.263076
H 5.015950 0.618178 1.205886
H 4.983925 -1.425238 -0.085080
H 4.634166 -0.485618 -1.552089
H -2.008236 1.334029 -1.948737
H -1.227736 -1.052022 1.592755
H -4.473571 1.099920 -1.576593
H -3.678313 -1.299620 1.981849
H -5.973456 -0.785103 1.234724
H -6.291102 0.173483 -0.186685


