%chk=000095539.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095539

0 1
 O  -0.4983000      0.3756000      0.3232000    
 O   0.7074000      0.9844000      -1.547300    
 C    1.796700      0.8428000      0.6189000    
 C    2.920700     -0.1174000      0.2048000    
 C    2.468500      -1.580800      0.2020000    
 C    2.291200       2.287200      0.6512000    
 C   0.6296000      0.7498000     -0.3480000    
 C   -2.837100     -0.1655000      0.4182000    
 C   -1.679400      0.2557000     -0.4758000    
 C   -4.130900     -0.3285000     -0.3745000    
 C    3.606000      -2.512300     -0.1869000    
 C   -5.274400     -0.7909000      0.5142000    
 H    1.452400      0.5739000       1.625500    
 H    3.287800      0.1458000     -0.7956000    
 H    3.766400     -1.7000000E-03  0.8944000    
 H    1.642200      -1.727300     -0.5024000    
 H    2.100700      -1.857200       1.196900    
 H    3.101400       2.404800       1.378100    
 H    2.664100       2.605900     -0.3285000    
 H    1.480900       2.968600      0.9328000    
 H   -2.970200      0.5760000       1.215800    
 H   -2.580000      -1.105200      0.9231000    
 H   -1.512100     -0.4966000      -1.255600    
 H   -1.898300       1.221600     -0.9457000    
 H   -3.985600      -1.058700      -1.179200    
 H   -4.401500      0.6237000     -0.8453000    
 H    3.975200      -2.282500      -1.191400    
 H    4.441500      -2.425600      0.5151000    
 H    3.263600      -3.551900     -0.1802000    
 H   -5.048300      -1.758700      0.9730000    
 H   -5.466800     -6.8000004E-02   1.313400    
 H   -6.191200     -0.8997000     -7.3600002E-02


%chk=000095539-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095539

0 1
O -0.526730 0.353649 0.332284
O 0.690096 0.970278 -1.556435
C 1.824194 0.837472 0.641271
C 2.961272 -0.120493 0.187350
C 2.575907 -1.616393 0.224173
C 2.317208 2.307327 0.690580
C 0.647496 0.737535 -0.324240
C -2.900806 -0.175102 0.396557
C -1.749754 0.241139 -0.519219
C -4.228540 -0.326296 -0.383886
C 3.745753 -2.533962 -0.191396
C -5.402556 -0.741414 0.528478
H 1.464884 0.532203 1.641162
H 3.269776 0.159989 -0.839345
H 3.836304 0.049726 0.846917
H 1.714220 -1.792334 -0.450517
H 2.233905 -1.883680 1.244605
H 3.178130 2.392919 1.377888
H 2.635751 2.638245 -0.313786
H 1.524742 2.990476 1.045569
H -3.020907 0.579329 1.197815
H -2.645712 -1.132056 0.891348
H -1.556493 -0.502384 -1.315193
H -1.930902 1.218878 -1.004090
H -4.100628 -1.078701 -1.188494
H -4.472113 0.631160 -0.887826
H 4.082593 -2.302062 -1.219217
H 4.612966 -2.403225 0.483479
H 3.453440 -3.599661 -0.163481
H -5.198659 -1.710785 1.020772
H -5.571300 0.009471 1.323009
H -6.341335 -0.843947 -0.045533


