%chk=000094707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094707

0 1
 O   0.6093000     -0.1245000     -6.6299997E-02
 O  -0.5298000     -0.3984000       1.913400    
 C   -1.770200      6.9600001E-02 -0.1424000    
 C   -1.674500       1.467800     -0.8175000    
 C   -1.862700      -1.001700      -1.266500    
 C   -3.021000      1.7000000E-03  0.7549000    
 C  -0.5153000     -0.1804000      0.7076000    
 C   -1.511300       2.647300      0.1359000    
 C   -1.998200      -2.443900     -0.7888000    
 C    3.013200     -0.2512000     -0.3664000    
 C    1.845800     -0.3424000      0.6202000    
 C    3.084200       1.130800      -1.019400    
 C    4.330400     -0.5748000      0.3354000    
 H   -2.571900       1.640100      -1.425900    
 H  -0.8271000       1.483900      -1.515300    
 H  -0.9756000     -0.9427000      -1.910400    
 H   -2.721400     -0.7765000      -1.912300    
 H   -3.934300      0.1640000      0.1722000    
 H   -2.991300      0.7527000       1.551400    
 H   -3.108900     -0.9664000       1.259600    
 H  -0.6245000       2.538100      0.7670000    
 H   -2.386000       2.770700      0.7802000    
 H   -1.396600       3.572800     -0.4383000    
 H   -2.947600      -2.611100     -0.2726000    
 H   -1.972200      -3.122000      -1.648400    
 H   -1.180500      -2.725400     -0.1189000    
 H    2.850400     -0.9838000      -1.167100    
 H    1.824700      -1.338900       1.077800    
 H    1.956700      0.4090000       1.411700    
 H    3.923100       1.185100      -1.721500    
 H    3.219400       1.917400     -0.2692000    
 H    2.169800       1.351000      -1.580000    
 H    5.166300     -0.5419000     -0.3714000    
 H    4.302100      -1.578800      0.7718000    
 H    4.538800      0.1389000       1.139800    


%chk=000094707-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094707

0 1
O 0.592496 -0.115469 -0.057720
O -0.544659 -0.355146 1.952930
C -1.824683 0.082944 -0.147941
C -1.709699 1.490108 -0.831406
C -1.875305 -0.996490 -1.284483
C -3.080472 0.003179 0.750967
C -0.573969 -0.153402 0.716480
C -1.526891 2.685852 0.127327
C -1.901738 -2.464209 -0.808030
C 3.012158 -0.260698 -0.362970
C 1.877724 -0.333560 0.668318
C 3.093801 1.135613 -1.020282
C 4.346972 -0.641942 0.321867
H -2.628497 1.636437 -1.434601
H -0.859526 1.459118 -1.539019
H -0.999082 -0.843775 -1.941921
H -2.778899 -0.788203 -1.892497
H -3.987075 0.156865 0.136539
H -3.057393 0.768379 1.544278
H -3.155611 -0.974957 1.254097
H -0.610527 2.578321 0.737000
H -2.380905 2.798746 0.818436
H -1.436200 3.626453 -0.446311
H -2.798494 -2.688403 -0.203747
H -1.905203 -3.149178 -1.675688
H -1.012452 -2.705896 -0.196616
H 2.793451 -1.009059 -1.151372
H 1.833255 -1.319445 1.167868
H 1.979245 0.444899 1.449051
H 3.877254 1.156749 -1.799810
H 3.344549 1.908169 -0.267440
H 2.131727 1.409439 -1.487012
H 5.176721 -0.615072 -0.407166
H 4.309030 -1.658503 0.756285
H 4.592195 0.068235 1.134890


