%chk=000138795.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138795

0 1
 O    2.309500       2.388900      0.2253000    
 O    2.879400      -2.006100      0.6565000    
 O   -2.306700       2.390800      0.2281000    
 O   -2.881900      -2.004600      0.6544000    
 O    3.509100      0.8483000     -0.9940000    
 O    3.047700      -2.002000      -1.639200    
 O   -3.507900      0.8541000     -0.9943000    
 O   -3.050200      -1.996800      -1.641400    
 C    1.208300      0.4628000     -0.5013000    
 C    1.207200     -0.9305000     -0.5673000    
 C   -1.207800      0.4647000     -0.5018000    
 C   -1.208800     -0.9286000     -0.5676000    
 C   7.9999998E-04   1.160300     -0.4686000    
 C  -1.3000000E-03  -1.626200     -0.6003000    
 C    2.454100       1.218100     -0.4656000    
 C    2.452000      -1.687700     -0.6024000    
 C   -2.452400       1.221900     -0.4656000    
 C   -2.454500      -1.683900     -0.6040000    
 C    3.468400       3.223000      0.3295000    
 C    4.097600      -2.751800      0.7541000    
 C   -3.465100       3.225300      0.3354000    
 C   -4.099800      -2.750900      0.7506000    
 C    3.114100       4.462600       1.122900    
 C    4.404400      -3.006200       2.214500    
 C   -3.109600       4.462600       1.131600    
 C   -4.406700      -3.007900       2.210500    
 H   1.5000000E-03   2.247700     -0.4506000    
 H  -2.0999999E-03  -2.713100     -0.6516000    
 H    4.268000       2.672500      0.8373000    
 H    3.803200       3.507200     -0.6742000    
 H    3.983700      -3.705100      0.2265000    
 H    4.911900      -2.178300      0.2977000    
 H   -4.264600       2.673800      0.8424000    
 H   -3.800600       3.512200     -0.6673000    
 H   -3.985400      -3.703400      0.2215000    
 H   -4.914300      -2.177100      0.2950000    
 H    2.759800       4.191600       2.122900    
 H    2.301600       5.012200      0.6362000    
 H    3.979000       5.124400       1.221700    
 H    3.588800      -3.562400       2.688200    
 H    4.502000      -2.060600       2.757900    
 H    5.331700      -3.575100       2.326000    
 H   -2.297200       5.013000      0.6457000    
 H   -2.754600       4.189000       2.130700    
 H   -3.974100       5.124600       1.232800    
 H   -4.504700      -2.063200       2.755500    
 H   -3.590900      -3.564500       2.683500    
 H   -5.333700      -3.577400       2.321000    


%chk=000138795-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138795

0 1
O 2.376471 2.204570 0.447897
O 3.271330 -1.865825 0.570303
O -2.374846 2.206277 0.448061
O -3.272215 -1.864384 0.570618
O 3.579166 0.627597 -0.774757
O 2.736997 -2.811758 -1.496689
O -3.579116 0.629578 -0.773396
O -2.739223 -2.809329 -1.497165
C 1.232290 0.210987 -0.214619
C 1.229802 -1.190776 -0.463643
C -1.232179 0.211815 -0.214452
C -1.230685 -1.189917 -0.463612
C 0.000293 0.892538 -0.090012
C -0.000681 -1.866498 -0.612496
C 2.514389 0.986435 -0.216668
C 2.483251 -2.018634 -0.561234
C -2.513812 0.988016 -0.216046
C -2.484795 -2.016755 -0.561438
C 3.587487 3.083706 0.451150
C 4.599229 -2.556005 0.537235
C -3.585386 3.086073 0.451746
C -4.600472 -2.553894 0.537709
C 3.210656 4.348298 1.214759
C 5.268632 -2.282717 1.879128
C -3.207594 4.350483 1.215175
C -5.269155 -2.281076 1.880057
H 0.000659 1.970271 0.082009
H -0.001026 -2.938255 -0.832782
H 4.413492 2.527489 0.929832
H 3.870771 3.285364 -0.597833
H 4.427789 -3.632233 0.355067
H 5.166969 -2.140706 -0.314568
H -4.411518 2.530316 0.930745
H -3.868946 3.287849 -0.597140
H -4.429644 -3.630098 0.354825
H -5.168359 -2.137797 -0.313605
H 2.910792 4.109502 2.249238
H 2.375518 4.874513 0.721618
H 4.077886 5.032367 1.252484
H 4.665192 -2.683178 2.711663
H 5.404837 -1.199015 2.034898
H 6.262278 -2.766100 1.905284
H -2.372363 4.876251 0.721716
H -2.907476 4.111555 2.249549
H -4.074451 5.035008 1.253204
H -5.404752 -1.197400 2.036533
H -4.665552 -2.682332 2.712090
H -6.263030 -2.763980 1.906360


