%chk=000156274.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156274

0 1
 O    1.270600      -1.260300     -6.3000000E-03
 O    3.126700      -2.419700      0.7338000    
 O   -4.950100     -0.9452000     -0.5982000    
 C    3.583300      0.9178000      0.4612000    
 C    4.708200     -2.2900000E-02  0.1947000    
 C    3.357100     -0.3146000     -0.3645000    
 C    3.517500       2.233500     -0.2404000    
 C    3.060100      0.9614000       1.857700    
 C    5.776600      0.3619000     -0.7472000    
 C    2.605700      -1.456100      0.1885000    
 C    6.893500       1.066500     -0.4830000    
 C    7.891200       1.377300      -1.563800    
 C    7.244400       1.597200      0.8783000    
 C   0.4185000      -2.299800      0.4853000    
 C   -1.009400      -1.940000      0.1973000    
 C   -1.591600      -2.338500      -1.000500    
 C   -1.736600      -1.210300       1.130900    
 C   -2.918800      -2.003000      -1.268300    
 C   -3.063800     -0.8750000      0.8631000    
 C   -3.654900      -1.271300     -0.3365000    
 C   -5.354000      0.3520000     -0.3304000    
 C   -4.544900       1.403800     -0.7206000    
 C   -6.555900      0.5624000      0.3210000    
 C   -4.951300       2.710500     -0.4499000    
 C   -6.962300       1.869100      0.5915000    
 C   -6.160000       2.943100      0.2060000    
 H    5.062000     -0.6419000       1.013500    
 H    3.209900     -0.1746000      -1.432300    
 H    2.501000       2.640000     -0.1924000    
 H    3.784100       2.171000      -1.301100    
 H    4.189900       2.957200      0.2330000    
 H    1.986600       1.179900       1.859600    
 H    3.564700       1.748000       2.429900    
 H    3.209800      2.3499999E-02   2.403800    
 H    5.635000      1.6899999E-02  -1.770500    
 H    7.592200      0.9717000      -2.536000    
 H    8.867800      0.9511000      -1.312000    
 H    8.002800       2.460700      -1.676000    
 H    6.496400       1.350500       1.637400    
 H    7.333200       2.688100      0.8461000    
 H    8.201100       1.181100       1.210500    
 H   0.5686000      -2.421300       1.565400    
 H   0.6756000      -3.249800      1.9999999E-04
 H   -1.026700      -2.906800      -1.734400    
 H   -1.286400     -0.8987000       2.069400    
 H   -3.373700      -2.313800      -2.204900    
 H   -3.619600     -0.3242000       1.617400    
 H   -3.611100       1.250100      -1.253500    
 H   -7.181100     -0.2726000      0.6221000    
 H   -4.329300       3.547000     -0.7548000    
 H   -7.903600       2.050300       1.102200    
 H   -6.477200       3.960500      0.4155000    


%chk=000156274-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156274

0 1
O 1.754006 -1.356966 -1.253111
O 2.024751 -0.861231 1.018669
O -4.685283 -0.723660 -0.697186
C 3.304625 1.849098 -0.110794
C 4.423156 0.850874 0.226103
C 3.234541 0.404465 -0.700444
C 3.562421 2.961326 -1.127769
C 2.351029 2.255878 1.010961
C 5.802660 0.935568 -0.317569
C 2.301152 -0.623860 -0.188276
C 6.939696 0.437863 0.255976
C 8.289132 0.617678 -0.420080
C 6.987147 -0.317035 1.572411
C 0.795870 -2.462633 -0.877754
C -0.632268 -1.974453 -0.812123
C -1.468061 -2.028072 -1.957153
C -1.168617 -1.465381 0.399182
C -2.801687 -1.576403 -1.904380
C -2.502069 -1.013078 0.470732
C -3.311765 -1.067754 -0.689145
C -5.201670 0.281937 0.160964
C -4.498878 1.474065 0.454595
C -6.518059 0.077136 0.628791
C -5.129316 2.463179 1.242000
C -7.136423 1.077224 1.410666
C -6.445130 2.271218 1.724825
H 4.328405 0.423382 1.231080
H 3.443705 0.321467 -1.770464
H 2.603968 3.337471 -1.530949
H 4.174787 2.625643 -1.982634
H 4.086892 3.808636 -0.646836
H 1.381318 2.593116 0.597610
H 2.786582 3.096007 1.584267
H 2.154103 1.421804 1.704322
H 5.910439 1.455120 -1.280971
H 8.204198 1.174903 -1.369191
H 8.758232 -0.362941 -0.637745
H 8.994444 1.164906 0.237304
H 5.996250 -0.461662 2.031237
H 7.628432 0.214005 2.304033
H 7.439412 -1.318228 1.426814
H 1.128713 -2.880112 0.088062
H 0.942554 -3.193310 -1.688789
H -1.069949 -2.421604 -2.900036
H -0.527887 -1.419307 1.286485
H -3.457630 -1.615905 -2.778879
H -2.910213 -0.639314 1.414583
H -3.487381 1.631313 0.067321
H -7.033664 -0.853021 0.371915
H -4.590493 3.389524 1.470188
H -8.157551 0.921177 1.775538
H -6.926823 3.043648 2.333449


