%chk=000002882.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002882

0 1
 O   -2.017600      -2.387800      0.7642000    
 O    1.056700      -2.974800     -0.6253000    
 O   -2.013700      -4.934300     -0.3633000    
 O   -2.453200       2.441200      0.7960000    
 O    3.236900       1.350600     -0.8435000    
 O   -2.725400      -1.000300      -1.375900    
 O    2.265800      -1.874700       1.456400    
 O   -2.946200       4.702300     -0.2480000    
 O    4.546500       3.305000      0.1107000    
 O   -3.433200       3.864300      -2.319400    
 O    4.730500       2.416300       2.209900    
 C  -0.7956000      -4.343500      9.5600002E-02
 C   -1.133900      -3.400100       1.242500    
 C  -0.1450000      -3.599200      -1.064900    
 C   -1.961500      -1.174800       1.381000    
 C    1.440900      -1.841600      -1.291300    
 C   -2.251200      2.0199999E-02  0.7188000    
 C    2.160300     -0.8219000     -0.6730000    
 C   -2.178900       1.237800       1.397700    
 C    2.527800      0.3134000      -1.397400    
 C   -1.598600      -1.143600       2.728200    
 C    1.087300      -1.730300      -2.633000    
 C   -2.637100      1.7800000E-02 -0.7034000    
 C    2.545300     -0.9188000      0.7461000    
 C   -1.815600       1.265500       2.744100    
 C    2.174600      0.4278000      -2.742000    
 C   -1.525700      7.3200002E-02   3.408100    
 C    1.454000     -0.5955000      -3.358500    
 C   -2.922300       1.336600      -1.303800    
 C    3.306700      0.2218000       1.294200    
 C   -2.813200       2.423300     -0.5334000    
 C    3.590200       1.245900      0.4836000    
 C   -3.102600       3.716500      -1.156400    
 C    4.346800       2.361800       1.055200    
 H  -0.1321000      -5.137900      0.4552000    
 H  -0.1999000      -2.987200       1.640900    
 H   -1.650900      -3.957300       2.032900    
 H   9.1399997E-02  -4.320700      -1.857300    
 H  -0.8694000      -2.885200      -1.475300    
 H   -1.397100      -2.041700       3.304500    
 H   0.5600000      -2.509800      -3.174200    
 H   -1.757900       2.208000       3.281500    
 H    2.457300       1.306700      -3.314700    
 H   -1.250300      9.1899998E-02   4.458700    
 H    1.185000     -0.5120000      -4.407600    
 H   -2.397700      -5.428600      0.3808000    
 H   -3.208100       1.358100      -2.348900    
 H    3.600300      0.1714000       2.336100    
 H   -3.131700       5.587200     -0.6286000    
 H    5.051600       4.071700      0.4563000    


%chk=000002882-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002882

0 1
O -1.774354 -2.082776 0.709441
O 0.989171 -2.702359 -0.615831
O -1.896797 -4.888559 -0.321978
O -3.599331 2.424119 0.905321
O 4.237846 0.902503 -0.958137
O -2.291933 -0.682669 -1.577181
O 2.134669 -1.639064 1.622395
O -4.820588 4.558127 -0.005083
O 6.182347 2.463242 -0.146448
O -4.769834 3.813256 -2.209658
O 6.048400 1.712396 2.052556
C -0.709110 -4.162727 0.139182
C -0.969766 -3.174639 1.287453
C -0.202525 -3.423177 -1.108307
C -2.034498 -0.948917 1.448020
C 1.565406 -1.705459 -1.372683
C -2.602249 0.156153 0.719125
C 2.534777 -0.887306 -0.691553
C -2.989818 1.292426 1.491576
C 3.230789 0.068022 -1.493651
C -1.801992 -0.853938 2.839847
C 1.269668 -1.496914 -2.738708
C -2.741654 0.191194 -0.764499
C 2.791558 -0.946088 0.774544
C -2.793157 1.391902 2.883072
C 2.972638 0.268425 -2.863387
C -2.179500 0.313005 3.542498
C 1.972643 -0.512796 -3.469638
C -3.437231 1.387051 -1.279341
C 3.892261 -0.076255 1.231952
C -3.822571 2.420356 -0.465730
C 4.548186 0.783603 0.389526
C -4.504830 3.636704 -0.998055
C 5.646346 1.675363 0.866568
H 0.070723 -4.869627 0.498016
H -0.002600 -2.772013 1.647380
H -1.525175 -3.663985 2.115432
H 0.078350 -4.141927 -1.899971
H -0.968792 -2.708934 -1.459527
H -1.328646 -1.678932 3.377320
H 0.497622 -2.093175 -3.230418
H -3.110573 2.297239 3.405291
H 3.542276 1.022602 -3.411003
H -1.996335 0.372261 4.620193
H 1.737361 -0.362226 -4.528067
H -2.300073 -5.380003 0.436766
H -3.626676 1.454720 -2.353224
H 4.173714 -0.106455 2.287202
H -5.272371 5.340648 -0.423669
H 6.906529 3.030301 0.235172


