%chk=000028331.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028331

0 1
 O   -1.985400     -0.4469000     -8.8100001E-02
 O   -3.925100       1.534900      0.2890000    
 C    1.639300       1.065400     -0.2182000    
 C    2.787000      3.9700001E-02  5.3100001E-02
 C   0.8262000      0.1985000      0.8032000    
 C    2.211200     -1.2900000E-02   1.505200    
 C    2.606900      -1.282200     -0.7138000    
 C   0.3009000      -1.066200      0.1861000    
 C    1.110800       1.155500      -1.635800    
 C    1.936800       2.478700      0.2613000    
 C    1.186100      -1.767900     -0.5463000    
 C   -1.120400      -1.453000      0.4140000    
 C   -3.352800     -0.7829000      0.1125000    
 C   -4.221500      0.3393000     -0.4222000    
 H    3.806200      0.4315000     -2.5400000E-02
 H   8.3099999E-02  0.7336000       1.402800    
 H    2.537100      0.7700000       2.196000    
 H    2.343800     -0.9642000       2.034100    
 H    3.295600      -2.037600     -0.3195000    
 H    2.836400      -1.146600      -1.776000    
 H    1.847600       1.634500      -2.291600    
 H   0.8561000      0.2059000      -2.109200    
 H   0.2005000       1.766300      -1.669000    
 H    2.678200       2.958800     -0.3886000    
 H    1.029700       3.094200      0.2338000    
 H    2.326600       2.550300       1.279200    
 H   0.8999000      -2.695000      -1.032100    
 H   -1.288900      -1.581000       1.490100    
 H   -1.345800      -2.405700     -8.0300003E-02
 H   -3.587400      -1.716900     -0.4097000    
 H   -3.533500     -0.9107000       1.186100    
 H   -5.282200      0.1046000     -0.2940000    
 H   -4.011200      0.5190000      -1.481200    
 H   -4.495200       2.232600     -7.6800004E-02


%chk=000028331-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028331

0 1
O -2.042955 -0.565663 -0.221693
O -3.706709 1.657341 0.102269
C 1.541681 1.109587 -0.233973
C 2.755079 0.127906 0.082274
C 0.743887 0.228379 0.835518
C 2.137346 -0.062096 1.514502
C 2.612233 -1.206125 -0.699906
C 0.284494 -1.078457 0.192446
C 1.011187 1.196858 -1.674662
C 1.804730 2.544235 0.280625
C 1.207686 -1.774311 -0.528890
C -1.127613 -1.551204 0.400679
C -3.457523 -0.793774 0.121242
C -4.209826 0.403043 -0.464889
H 3.774858 0.543745 0.001087
H -0.048264 0.724768 1.420316
H 2.450028 0.721426 2.222261
H 2.254383 -1.052244 1.985278
H 3.369065 -1.936547 -0.345144
H 2.821142 -1.048093 -1.778826
H 1.757097 1.689676 -2.328201
H 0.772488 0.209893 -2.101601
H 0.084804 1.801635 -1.706993
H 2.545670 3.052945 -0.365713
H 0.872409 3.139915 0.251279
H 2.187810 2.572160 1.315159
H 0.956912 -2.727593 -1.013559
H -1.367890 -1.616553 1.487145
H -1.289417 -2.550340 -0.057150
H -3.819844 -1.751138 -0.313185
H -3.576806 -0.826168 1.226114
H -5.280449 0.355246 -0.203715
H -4.104958 0.397958 -1.570119
H -2.716135 1.607189 0.038721


