%chk=000072964.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072964

0 1
 O  -0.7090000      -2.681200      0.6437000    
 O  -0.3800000       2.658600     -0.4722000    
 O   -2.085700      -3.351000       2.408800    
 O    1.467200       1.815100       1.318400    
 O   -3.065300       2.974200     -0.2000000    
 O    4.194900       1.722400       1.318400    
 C   -1.228500     -0.8340000     -0.9086000    
 C  -0.3556000      0.2351000     -0.1789000    
 C    1.186000      0.1850000     -0.4980000    
 C    1.703700      -1.284700     -0.3112000    
 C  -0.6188000      -2.247600     -0.7204000    
 C   -2.667700     -0.8039000     -0.2885000    
 C   0.8654000      -2.309900      -1.096100    
 C    3.225200      -1.403400     -0.6140000    
 C   -1.367700     -0.5616000      -2.432500    
 C   -2.730300      -1.469500       1.096700    
 C   -1.019000       1.616200     -0.3322000    
 C   -3.268100      0.5961000     -0.2153000    
 C    1.540800      0.7493000      -1.895800    
 C    1.982500      0.9923000      0.5634000    
 C   -2.051500      -2.829900       1.083900    
 C   -2.509600       1.711600     -0.2378000    
 C    4.002500     -0.3078000      7.6099999E-02
 C    3.456900      0.7718000      0.6483000    
 C    3.794300      -2.761400     -0.1816000    
 C   -4.773300      0.6532000     -0.1463000    
 C   -3.208200       3.419700       1.134600    
 C    4.619000       2.745200      0.4371000    
 H  -0.4239000      3.8400002E-02  0.9020000    
 H    1.580500      -1.534100      0.7556000    
 H   -1.155400      -2.979100      -1.339700    
 H   -3.311000      -1.402100     -0.9511000    
 H    1.001800      -2.178100      -2.173700    
 H    1.219800      -3.320200     -0.8617000    
 H    3.399000      -1.304300      -1.692900    
 H   -2.087600      -1.256500      -2.882300    
 H   -1.721600      0.4500000      -2.651900    
 H  -0.4353000     -0.7023000      -2.978800    
 H   -2.255000     -0.8305000       1.852600    
 H   -3.769500      -1.590200       1.427700    
 H   0.8338000       1.509400      -2.236800    
 H    2.525300       1.229400      -1.915700    
 H    1.563600     -2.8300000E-02  -2.663200    
 H   -2.588900      -3.528300      0.4307000    
 H    5.084200     -0.4189000      0.1146000    
 H    3.579300      -2.968900      0.8725000    
 H    3.381400      -3.577300     -0.7820000    
 H    4.882200      -2.794500     -0.3135000    
 H   -5.128800      0.2596000      0.8106000    
 H   -5.211000      5.4400001E-02 -0.9521000    
 H   -5.170100       1.666900     -0.2555000    
 H   -2.009200      -4.317600       2.337100    
 H   -3.650100       4.420400       1.113900    
 H   -2.236000       3.491800       1.634900    
 H   -3.876100       2.769600       1.710200    
 H    5.185300       3.481000       1.015800    
 H    3.764600       3.258600     -1.8100001E-02
 H    5.278600       2.349300     -0.3431000    


%chk=000072964-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072964

0 1
O -0.643342 -2.823345 0.589697
O -0.349408 2.575835 -0.825183
O -1.919273 -3.483589 2.440075
O 1.325171 1.558667 1.400360
O -3.087190 2.894571 -0.143897
O 4.238962 1.658496 1.164426
C -1.280367 -0.920855 -0.948897
C -0.358957 0.158170 -0.277646
C 1.170296 0.096474 -0.604818
C 1.687216 -1.386040 -0.410177
C -0.637086 -2.337666 -0.809581
C -2.671894 -0.888889 -0.210786
C 0.838226 -2.381170 -1.232771
C 3.211584 -1.497079 -0.703060
C -1.545547 -0.664339 -2.458658
C -2.640592 -1.546142 1.206013
C -0.993916 1.550086 -0.451958
C -3.256118 0.514634 -0.094730
C 1.562249 0.639549 -2.014368
C 1.918138 0.899559 0.497867
C -2.011450 -2.930509 1.120111
C -2.457750 1.635742 -0.163772
C 3.985405 -0.360132 -0.065081
C 3.410446 0.756279 0.481415
C 3.803256 -2.857384 -0.243128
C -4.753133 0.628858 0.068040
C -2.445195 3.975230 0.640374
C 3.835782 3.081532 1.205470
H -0.421336 -0.037765 0.814778
H 1.539684 -1.650546 0.658308
H -1.234861 -3.047523 -1.429319
H -3.376335 -1.494489 -0.825540
H 0.925790 -2.177012 -2.316359
H 1.201670 -3.411231 -1.068633
H 3.359462 -1.429397 -1.805591
H -2.220013 -1.444353 -2.861041
H -2.032675 0.312225 -2.621268
H -0.623065 -0.678256 -3.058549
H -2.048136 -0.946324 1.919101
H -3.666103 -1.628021 1.607757
H 1.053331 1.593317 -2.212383
H 2.649086 0.816392 -2.076159
H 1.299441 -0.075673 -2.812337
H -2.587881 -3.598907 0.431294
H 5.077454 -0.457060 0.002634
H 3.636610 -3.007945 0.839213
H 3.348566 -3.705700 -0.784265
H 4.892733 -2.891489 -0.427279
H -5.138975 -0.107883 0.797592
H -5.262953 0.419547 -0.894828
H -5.041523 1.642395 0.384938
H -1.360600 -4.302206 2.404797
H -3.169839 4.803683 0.613245
H -1.489762 4.272094 0.181631
H -2.279896 3.651827 1.685806
H 4.682152 3.592792 1.688618
H 2.912450 3.209718 1.791866
H 3.690016 3.478749 0.182738


