%chk=000089272.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089272

0 1
 O   -3.028400       1.186700     -0.5036000    
 O   -1.925900      -1.368800     -0.7100000    
 O  -0.5198000       1.850700      0.5296000    
 O   -2.094400      -2.631000       1.207700    
 O   0.7469000       1.409500       2.400400    
 C   -2.882000       2.257200      0.4283000    
 C   -3.339800      -1.178300     -0.7238000    
 C   -3.663100      6.6200003E-02  9.3000002E-02
 C   -1.693400       1.948200       1.329500    
 C   -2.675500       3.553500     -0.3405000    
 C   -3.802600      -1.033500      -2.165600    
 C   -1.438400      -2.117300      0.3147000    
 C   3.8100000E-02  -2.238600      0.2158000    
 C   0.6346000       1.576300       1.195900    
 C    1.779400       1.502600      0.2533000    
 C   0.8054000      -2.378400       1.372200    
 C   0.6579000      -2.213100      -1.033700    
 C    3.061100       1.231400      0.7325000    
 C    1.573500       1.704100      -1.111600    
 C    2.192500      -2.492600       1.279400    
 C    2.045000      -2.327500      -1.126400    
 C    2.812200      -2.467200      3.0200001E-02
 C    4.136600       1.162000     -0.1529000    
 C    2.649000       1.634500      -1.996900    
 C    3.930700       1.363400      -1.517600    
 H   -3.794400       2.356200       1.030200    
 H   -3.857700      -2.045400     -0.2951000    
 H   -4.744800      0.2437000      0.1022000    
 H   -3.344400     -9.3000002E-02   1.126600    
 H   -1.564900       2.760900       2.055000    
 H   -1.818800       1.014800       1.885200    
 H   -1.827100       3.484100      -1.030000    
 H   -3.554900       3.766900     -0.9580000    
 H   -2.514500       4.398700      0.3356000    
 H   -4.877400     -0.8368000      -2.223500    
 H   -3.588400      -1.952800      -2.721900    
 H   -3.266600     -0.2306000      -2.683400    
 H   0.3380000      -2.395100       2.353300    
 H   8.4600002E-02  -2.115600      -1.951700    
 H    3.242400       1.069700       1.791800    
 H   0.5928000       1.915500      -1.528200    
 H    2.790300      -2.598800       2.179900    
 H    2.528200      -2.308100      -2.099000    
 H    3.892400      -2.554500     -4.2100001E-02
 H    5.134300      0.9494000      0.2200000    
 H    2.489100       1.789800      -3.059900    
 H    4.767900       1.308000      -2.207100    


%chk=000089272-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089272

0 1
O -3.124039 1.339589 -0.310228
O -1.904784 -1.484636 -0.606775
O -0.118309 1.398457 0.244770
O -2.905153 -3.209098 0.615363
O 1.001124 2.910064 1.635963
C -2.482210 1.923294 0.883822
C -3.253423 -1.026261 -1.081287
C -3.799705 0.050208 -0.124336
C -1.173029 1.208978 1.270623
C -2.288269 3.410446 0.570428
C -3.057688 -0.533136 -2.515000
C -1.870829 -2.592805 0.248956
C -0.476525 -2.935383 0.655105
C 0.922463 2.284503 0.548924
C 1.912679 2.369159 -0.564494
C -0.277444 -4.100140 1.441911
C 0.632687 -2.128708 0.286276
C 3.068079 3.169718 -0.368771
C 1.725744 1.680805 -1.792130
C 1.022599 -4.460040 1.851204
C 1.930863 -2.492546 0.702009
C 2.128894 -3.657044 1.481710
C 4.032958 3.277097 -1.391130
C 2.694020 1.792879 -2.812284
C 3.848071 2.588303 -2.614155
H -3.164726 1.802810 1.757756
H -3.932331 -1.899785 -1.031335
H -4.872635 0.203403 -0.361300
H -3.726599 -0.308226 0.922188
H -0.807044 1.601418 2.237352
H -1.316859 0.118885 1.326389
H -1.702047 3.524759 -0.357143
H -3.265847 3.897645 0.422100
H -1.748862 3.915060 1.390650
H -4.027545 -0.215766 -2.939527
H -2.644264 -1.337819 -3.145730
H -2.377413 0.333448 -2.527617
H -1.149235 -4.702863 1.717414
H 0.467207 -1.227128 -0.310482
H 3.187100 3.694207 0.585069
H 0.825171 1.076106 -1.932999
H 1.175828 -5.360474 2.455773
H 2.785778 -1.868004 0.421224
H 3.139022 -3.936164 1.802135
H 4.924643 3.894616 -1.238691
H 2.549973 1.264259 -3.760800
H 4.597611 2.672912 -3.409101


