%chk=000155861.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155861

0 1
 O   -1.507900      -2.990700       1.902500    
 O   -1.552500     -0.6129000      -2.261300    
 C   -5.662600      0.7659000      0.3641000    
 C   -4.794300     -0.2594000     -0.3346000    
 C   -3.018900      -2.105900     -0.3372000    
 C   -5.083400       2.186800      0.3409000    
 C   -1.549000      -1.805800     -0.1816000    
 C   -3.886200      -1.043900      0.2785000    
 C  -0.8710000      -2.268700      0.9381000    
 C  -0.8935000      -1.070600      -1.159800    
 C   -5.031400     -0.3986000      -1.816700    
 C   -3.806100       2.302400       1.125700    
 C    1.156800      -1.253400      0.1051000    
 C   0.4885000      -1.991100       1.082000    
 C   0.4658000     -0.7930000      -1.015700    
 C   -2.592800       2.688900      0.6882000    
 C    2.574200     -0.9638000      0.2553000    
 C   -1.353200       2.782000       1.531400    
 C   -2.395500       3.088500     -0.7499000    
 C    3.240100      2.7200000E-02 -0.3836000    
 C    4.671900      0.3333000     -0.2172000    
 C    5.517600     -0.6361000      0.2975000    
 C    5.145100       1.584100     -0.5791000    
 C    6.873100     -0.3467000      0.4546000    
 C    6.500500       1.873500     -0.4221000    
 C    7.364500      0.9081000      9.4700001E-02
 H   -5.821900      0.4566000       1.406000    
 H   -6.659500      0.7704000     -9.4700001E-02
 H   -3.270700      -3.071100      0.1202000    
 H   -3.237600      -2.290200      -1.392600    
 H   -5.814000       2.857800      0.8108000    
 H   -4.990900       2.534700     -0.6907000    
 H   -3.771500     -0.9199000       1.355100    
 H   -5.936200     -0.9889000      -1.995200    
 H   -4.210500     -0.8446000      -2.377600    
 H   -5.185200      0.5907000      -2.262700    
 H   -3.895500       2.038900       2.179200    
 H    1.015600      -2.354400       1.961700    
 H   0.9610000     -0.2356000      -1.805800    
 H    3.087500      -1.599800      0.9713000    
 H  -0.5827000       2.100900       1.155500    
 H   -1.555100       2.514500       2.573800    
 H  -0.9579000       3.802600       1.518100    
 H   -3.078200       2.592600      -1.443600    
 H   -1.388700       2.810200      -1.083300    
 H   -2.497300       4.172800     -0.8590000    
 H    2.719400      0.7010000      -1.058600    
 H   -2.457800      -2.796200       1.905700    
 H  -0.9328000     -0.1145000      -2.821000    
 H    5.184700      -1.632600      0.5691000    
 H    4.484900       2.347700     -0.9819000    
 H    7.547400      -1.099700      0.8520000    
 H    6.883400       2.850600     -0.7023000    
 H    8.420100       1.133100      0.2157000    


%chk=000155861-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155861

0 1
O -1.620680 -2.619297 1.906377
O -1.601169 -0.824406 -2.615956
C -5.739636 0.752817 0.390330
C -4.912720 -0.197578 -0.470048
C -3.135510 -2.078322 -0.585562
C -5.106505 2.184733 0.515638
C -1.663642 -1.727006 -0.391776
C -4.062788 -1.088973 0.115831
C -0.980292 -1.987856 0.824734
C -0.912562 -1.082366 -1.409690
C -5.093501 -0.039291 -1.970742
C -3.894428 2.204986 1.423420
C 1.100742 -0.986890 -0.009981
C 0.370208 -1.631939 1.021389
C 0.436165 -0.714190 -1.240762
C -2.581217 2.334765 1.076269
C 2.505610 -0.631511 0.244185
C -1.486479 2.274882 2.130197
C -2.076335 2.520620 -0.343269
C 3.363407 -0.000005 -0.618068
C 4.768398 0.356709 -0.362941
C 5.442082 0.075931 0.863372
C 5.504651 1.018476 -1.388900
C 6.788880 0.442735 1.049170
C 6.853583 1.386065 -1.203801
C 7.504793 1.100137 0.018140
H -5.865698 0.338852 1.409199
H -6.754505 0.858908 -0.045504
H -3.330225 -3.107256 -0.207835
H -3.350066 -2.111178 -1.664050
H -5.883449 2.860222 0.928701
H -4.863504 2.567605 -0.492592
H -4.006980 -1.075330 1.215883
H -6.058615 -0.475759 -2.297733
H -4.283064 -0.505537 -2.553347
H -5.125050 1.033408 -2.243622
H -4.121617 2.060062 2.492305
H 0.839445 -1.864513 1.982475
H 0.971288 -0.221023 -2.061322
H 2.872947 -0.914869 1.240440
H -0.815699 1.411472 1.945814
H -1.901057 2.175078 3.148636
H -0.850941 3.182616 2.102871
H -2.883807 2.540254 -1.092806
H -1.386397 1.696220 -0.610213
H -1.499420 3.463286 -0.430714
H 2.994111 0.284762 -1.614237
H -2.560228 -2.832690 1.681223
H -1.001326 -0.387001 -3.269064
H 4.911116 -0.432042 1.675932
H 5.006373 1.244233 -2.340353
H 7.286497 0.217151 1.999291
H 7.396154 1.893934 -2.009099
H 8.552462 1.383613 0.167165


