%chk=000127055.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127055

0 1
 O    1.859100      -2.082700      0.4504000    
 O   -4.351500      0.2660000     -0.7505000    
 O    3.857600     -0.1911000      0.4839000    
 O    3.283000       2.473700      4.7300000E-02
 O   -2.055400       2.177600     -0.6781000    
 O   -4.657700      0.5486000       1.552800    
 O    4.143000     -0.4855000      -1.820900    
 C   0.2556000     -0.3612000     -8.2000000E-03
 C  -0.9847000      -1.102400     -8.6599998E-02
 C  -7.4000000E-03   1.002200     -0.2272000    
 C   -2.038000     -0.2114000     -0.3556000    
 C   -1.461100       1.146000     -0.4541000    
 C    1.553200     -0.7768000      0.2324000    
 C   0.9723000       1.974100     -0.2166000    
 C   -3.352300     -0.6104000     -0.4904000    
 C   -1.251100      -2.452700      5.4900002E-02
 C    2.566800      0.1898000      0.2484000    
 C    2.278800       1.550200      2.6300000E-02
 C   -3.615900      -1.972500     -0.3469000    
 C   -2.576900      -2.884300     -7.7200003E-02
 C    2.464400      -2.410000       1.701500    
 C    3.580000       3.076700       1.304100    
 C   -4.960600      0.8093000      0.3960000    
 C    4.575000     -0.5168000     -0.6763000    
 C    5.973500     -0.9199000     -0.3134000    
 C   -6.049400       1.763500      3.8000001E-03
 H   0.7390000       3.018500     -0.3894000    
 H  -0.4720000      -3.177200      0.2623000    
 H   -4.633100      -2.344400     -0.4436000    
 H   -2.809800      -3.940800      2.9899999E-02
 H    2.081700      -3.386000       2.014100    
 H    2.221800      -1.682000       2.483600    
 H    3.547900      -2.494500       1.581800    
 H    2.712400       3.628500       1.679400    
 H    4.405600       3.779200       1.160600    
 H    3.887700       2.319800       2.032500    
 H    6.474500     -9.3999997E-02  0.1975000    
 H    6.530800      -1.156400      -1.224200    
 H    5.948300      -1.808200      0.3224000    
 H   -5.627300       2.582000     -0.5844000    
 H   -6.508600       2.180600      0.9045000    
 H   -6.815900       1.233700     -0.5669000    


%chk=000127055-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127055

0 1
O 1.587130 -2.470240 0.664652
O -4.580118 0.154632 -0.412376
O 3.795098 -0.509357 0.952113
O 3.347156 2.085113 0.502551
O -2.155820 2.100290 -0.303912
O -4.395699 1.217294 1.677137
O 4.640700 -0.191574 -1.215861
C 0.114628 -0.621120 0.309740
C -1.179274 -1.340814 0.214322
C -0.118225 0.767698 0.141458
C -2.209630 -0.369747 0.000054
C -1.590616 0.992288 -0.077943
C 1.432974 -1.092605 0.509979
C 0.902045 1.726904 0.167828
C -3.546036 -0.774820 -0.136905
C -1.493068 -2.708661 0.288840
C 2.477373 -0.125935 0.576146
C 2.220158 1.267055 0.399826
C -3.875847 -2.150453 -0.078901
C -2.852126 -3.099116 0.131993
C 2.857165 -3.128233 0.292208
C 3.152395 3.524910 0.290485
C -4.831624 1.223765 0.516927
C 4.850792 -0.353894 -0.003623
C 6.177648 -0.439515 0.706108
C -5.681267 2.269818 -0.153230
H 0.661135 2.782893 0.023785
H -0.708558 -3.448058 0.462509
H -4.920526 -2.454449 -0.191702
H -3.115542 -4.161334 0.182792
H 2.595297 -4.192733 0.192591
H 3.614181 -2.993500 1.081410
H 3.232718 -2.740701 -0.672133
H 2.761747 3.724932 -0.724608
H 4.152490 3.967818 0.400498
H 2.467513 3.948155 1.049221
H 6.346911 0.503430 1.256557
H 6.987552 -0.584748 -0.023106
H 6.173811 -1.254748 1.448296
H -5.012016 2.906978 -0.759685
H -6.181077 2.892360 0.603337
H -6.418248 1.808821 -0.829476


