%chk=000130689.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130689

0 1
 O    2.614500      2.9100001E-02   1.533700    
 O   -1.191900      -2.727000     -0.8168000    
 O    4.681500      -1.010800     -0.7735000    
 O    4.728500       1.728200      0.5262000    
 O    2.956800       3.201300      0.3597000    
 O    4.864200      -3.071300       1.049100    
 O   -6.510500       1.004300       1.857700    
 C    1.214000     -0.7604000     -0.3507000    
 C   0.4765000      0.5942000     -0.4336000    
 C  -0.9662000      0.4805000     -0.9509000    
 C   -1.780300     -0.4448000      2.0500001E-02
 C    2.608700     -0.2641000      0.1405000    
 C   0.4293000      -1.655900      0.6312000    
 C    1.459100       1.486800      -1.190000    
 C   -1.061900      -1.810300      0.2587000    
 C    2.850000       1.032700     -0.6847000    
 C   -3.309100     -0.5263000     -0.3722000    
 C   -1.609500       1.874800      -1.061100    
 C    1.382000      -1.458100      -1.730300    
 C   -3.081600       1.805100      -1.446700    
 C   -3.828100      0.9108000     -0.4909000    
 C    3.722100      -1.255500     -4.3499999E-02
 C   -3.589600      -1.241300      -1.712700    
 C    3.489200       2.126000      0.1201000    
 C   -4.078200      -1.302500      0.6871000    
 C   -4.852700       1.396200      0.2276000    
 C    3.591500      -2.558900      0.7156000    
 C   -5.097800     -0.8248000       1.407400    
 C   -5.565500      0.5600000       1.214800    
 C    5.455000       2.681800       1.307800    
 H   0.4059000       1.015000      0.5832000    
 H  -0.9655000      4.6399999E-02  -1.955400    
 H   -1.747600      5.9700001E-02   1.001700    
 H   0.4772000      -1.232700       1.642100    
 H   0.8802000      -2.652300      0.6791000    
 H    1.233400       2.546400      -1.042500    
 H    1.381800       1.300900      -2.268700    
 H   -1.534500      -2.303200       1.115800    
 H    3.473100      0.8796000      -1.574500    
 H   -1.080500       2.473700      -1.811700    
 H   -1.509600       2.406700     -0.1055000    
 H    1.674500      -2.506200      -1.608800    
 H   0.4759000      -1.445700      -2.335500    
 H    2.151600     -0.9856000      -2.350000    
 H   -3.187600       1.429500      -2.470800    
 H   -3.495100       2.821100      -1.450500    
 H   -4.621200      -1.065800      -2.046100    
 H   -2.932300     -0.8991000      -2.517800    
 H   -3.478200      -2.328400      -1.636800    
 H   -3.795100      -2.339200      0.8557000    
 H    3.503300      0.3281000       1.790300    
 H   -1.198600      -2.233000      -1.650400    
 H   -5.187100       2.423300      0.1249000    
 H    3.080200      -3.291900      8.8100001E-02
 H    3.036200      -2.427800       1.646700    
 H   -5.610100      -1.440600       2.137400    
 H    5.276200      -2.449000       1.672600    
 H    4.913200       2.904400       2.232000    
 H    5.625300       3.594700      0.7292000    
 H    6.422700       2.243300       1.565200    


%chk=000130689-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130689

0 1
O 2.396845 0.071971 1.594031
O -1.376052 -2.839085 -0.680720
O 4.320744 -1.478981 -1.045729
O 4.513262 1.608142 0.935886
O 3.652887 3.313056 -0.395197
O 4.907657 -3.280197 0.851688
O -6.586148 0.788036 2.010438
C 1.151268 -0.758232 -0.344806
C 0.439048 0.626200 -0.474334
C -1.010050 0.527682 -0.993994
C -1.823761 -0.399059 -0.033283
C 2.572955 -0.263303 0.177062
C 0.365254 -1.624171 0.665896
C 1.452316 1.499617 -1.248372
C -1.142185 -1.763866 0.311789
C 2.844076 1.001153 -0.729238
C -3.357137 -0.507984 -0.467704
C -1.653557 1.936940 -1.050959
C 1.325910 -1.473809 -1.715638
C -3.172006 1.899956 -1.375334
C -3.894992 0.926203 -0.466722
C 3.673639 -1.319645 0.030341
C -3.558832 -1.127176 -1.896868
C 3.662024 2.107809 -0.079922
C -4.102551 -1.410191 0.497865
C -4.930654 1.317899 0.338069
C 3.983896 -2.228772 1.216789
C -5.138971 -1.002822 1.284124
C -5.623677 0.399108 1.267053
C 5.453494 2.594869 1.535217
H 0.382464 1.029693 0.559186
H -1.009026 0.107248 -2.020812
H -1.845258 0.136039 0.944163
H 0.454387 -1.156443 1.662879
H 0.777036 -2.649221 0.740096
H 1.324985 2.578993 -1.065757
H 1.366681 1.338451 -2.338670
H -1.649122 -2.170662 1.203647
H 3.469695 0.648167 -1.575896
H -1.132125 2.560192 -1.802047
H -1.511787 2.428312 -0.066107
H 1.608963 -2.532829 -1.577167
H 0.395550 -1.436891 -2.312626
H 2.111831 -1.016629 -2.339635
H -3.305288 1.599311 -2.434624
H -3.604409 2.911636 -1.272863
H -4.620469 -1.037486 -2.188721
H -2.952976 -0.612935 -2.663038
H -3.277850 -2.191320 -1.886378
H -3.788317 -2.462344 0.496407
H 3.202781 0.595326 1.864172
H -0.824337 -2.678463 -1.485419
H -5.292096 2.354059 0.329353
H 3.044916 -2.665294 1.609355
H 4.409668 -1.607506 2.033142
H -5.666753 -1.694428 1.951250
H 5.224284 -3.085012 -0.075641
H 4.891379 3.426683 1.990146
H 6.123092 2.987126 0.753406
H 6.015102 2.026984 2.289872


