%chk=000147204.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147204

0 1
 O   -2.308100      -2.008700      0.7841000    
 O  -0.9736000      -3.903800       1.095400    
 O   -3.371200       3.000300      -1.148500    
 O   -4.907400       1.988400      0.4073000    
 O    2.321500       1.627100       2.130700    
 O    4.409500      9.4700001E-02  -1.898100    
 O    4.565500       1.441300      0.5166000    
 C  -0.3228000     -0.9202000      -1.118400    
 C  -0.3873000      -2.409700     -0.7015000    
 C  -0.9787000      -2.528300      0.7123000    
 C   -1.560100     -0.1708000     -0.6583000    
 C   0.9933000     -0.2845000     -0.6776000    
 C   -2.464700     -0.7504000      0.2605000    
 C   -1.196100      -3.226000      -1.726200    
 C   -1.823800       1.112800      -1.170500    
 C   -3.624500     -7.2400004E-02  0.6546000    
 C    2.112500     -0.3853000      -1.495300    
 C    1.059200      0.3885000      0.5367000    
 C   -2.967400       1.762200     -0.7531000    
 C   -3.843600       1.185200      0.1337000    
 C    2.261900      0.9691000      0.9392000    
 C    3.315200      0.1952000      -1.092800    
 C    3.390100      0.8726000      0.1243000    
 C   -1.510200      -4.079900       2.397800    
 C   -4.602300       3.136800     -0.4099000    
 C    2.022900       3.021500       2.116500    
 C    5.258500      -1.034000      -1.699800    
 C    5.131400      0.9784000       1.740600    
 H  -0.3367000     -0.8746000      -2.218000    
 H   0.6189000      -2.851100     -0.6983000    
 H  -0.3488000      -1.985900       1.429400    
 H  -0.7383000      -3.154400      -2.718900    
 H   -1.218400      -4.286400      -1.454300    
 H   -2.230600      -2.878000      -1.808700    
 H   -1.150800       1.582100      -1.881000    
 H   -4.327900     -0.5194000       1.349100    
 H    2.058600     -0.9133000      -2.443900    
 H   0.2013000      0.4665000       1.198000    
 H   -1.376300      -5.127800       2.680700    
 H   -2.582000      -3.861000       2.414600    
 H  -0.9829000      -3.457400       3.127500    
 H   -4.527500       4.018200      0.2372000    
 H   -5.422800       3.290100      -1.120400    
 H    2.125700       3.404100       3.135600    
 H   0.9945000       3.189400       1.781100    
 H    2.722200       3.559600       1.468600    
 H    6.086600     -0.9687000      -2.410800    
 H    4.710300      -1.963000      -1.885500    
 H    5.668300      -1.036300     -0.6851000    
 H    4.856200       1.649900       2.558700    
 H    6.220300       1.000400       1.637200    
 H    4.832000     -4.9500000E-02   1.973400    


%chk=000147204-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147204

0 1
O -2.360933 -1.898192 0.931052
O -1.170581 -3.920390 1.127417
O -3.507398 3.052701 -1.398632
O -4.990820 2.189459 0.277042
O 2.258661 1.505336 2.256207
O 4.473615 -0.671867 -1.607062
O 4.696456 0.859560 0.851339
C -0.433509 -0.993981 -1.146637
C -0.610153 -2.501380 -0.750563
C -1.029466 -2.563720 0.724204
C -1.655760 -0.182733 -0.721864
C 0.898104 -0.428349 -0.623194
C -2.542348 -0.662550 0.280671
C -1.612611 -3.233932 -1.667400
C -1.926041 1.072166 -1.344222
C -3.704699 0.059080 0.678559
C 2.086959 -0.704297 -1.340150
C 0.979216 0.340063 0.562610
C -3.062512 1.773910 -0.953496
C -3.936403 1.271361 0.036614
C 2.228944 0.792770 1.033973
C 3.345830 -0.266015 -0.871320
C 3.431179 0.466115 0.346902
C -1.442003 -4.089652 2.565149
C -4.857031 3.206437 -0.801806
C 2.790583 2.885171 2.164317
C 5.452051 0.374190 -1.979253
C 5.091812 0.130243 2.082456
H -0.378845 -0.975615 -2.253702
H 0.374781 -2.999455 -0.821001
H -0.312688 -2.021795 1.381689
H -1.233047 -3.256522 -2.705376
H -1.758717 -4.271070 -1.323230
H -2.596696 -2.733748 -1.671451
H -1.249027 1.466904 -2.107659
H -4.365375 -0.340560 1.450117
H 2.063832 -1.274401 -2.275666
H 0.081813 0.622254 1.121442
H -1.411005 -5.174286 2.747477
H -2.436166 -3.685222 2.822507
H -0.665359 -3.583390 3.174548
H -4.942305 4.209953 -0.358490
H -5.622972 3.006858 -1.576341
H 2.774210 3.272573 3.194431
H 2.134205 3.500943 1.520619
H 3.820463 2.884804 1.765354
H 6.244840 -0.160132 -2.524649
H 5.858049 0.871128 -1.083282
H 4.975220 1.119198 -2.645354
H 4.351347 0.301191 2.884422
H 6.071525 0.543260 2.367978
H 5.182378 -0.950776 1.869204


