%chk=000158315.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158315

0 1
 O   -4.524600       1.134900     -0.3649000    
 O    4.457600       1.300800      0.8726000    
 O   -4.104900     -0.1387000       2.089100    
 C   -3.757900     -9.1600001E-02 -0.3180000    
 C   -2.292300      0.1733000     -0.2347000    
 C    4.217200      0.1072000      9.0499997E-02
 C    2.751800     -0.1582000      7.0000002E-03
 C  -7.4999998E-03 -0.6581000     -0.1522000    
 C   0.4669000      0.6732000     -7.5499997E-02
 C   -1.390200     -0.8910000     -0.2312000    
 C    1.849700      0.9061000      3.8000001E-03
 C   -1.825700       1.482300     -0.1591000    
 C   -4.309400     -0.8904000      0.8959000    
 C  -0.4555000       1.732200     -7.9999998E-02
 C    2.285100      -1.467200     -6.8499997E-02
 C   0.9147000      -1.717100     -0.1476000    
 C   -4.121600     -0.8512000      -1.618200    
 C    5.052100     -0.9979000      0.7910000    
 C    4.794700      0.3513000      -1.300100    
 H   -1.754000      -1.915300     -0.2851000    
 H    2.210300       1.932000      4.9199998E-02
 H   -2.496100       2.336600     -0.1567000    
 H   -5.389700      -1.044700      0.8015000    
 H   -3.832400      -1.869200       1.010900    
 H  -0.1133000       2.763400     -2.1100000E-02
 H    2.955900      -2.320000     -8.3999999E-02
 H   0.5726000      -2.748100     -0.2092000    
 H   -3.788800     -0.2889000      -2.499100    
 H   -3.671900      -1.848400      -1.659200    
 H   -5.207800     -0.9657000      -1.715100    
 H    4.640100      -1.230400       1.780200    
 H    5.099100      -1.921900      0.2059000    
 H    6.080600     -0.6551000      0.9564000    
 H    4.308600       1.204700      -1.788400    
 H    5.861100      0.6003000      -1.244900    
 H    4.677800     -0.5221000      -1.951300    
 H   -5.467400      0.9024000     -0.4180000    
 H    4.076200       1.159400       1.756400    
 H   -3.149100     -0.1152000       2.264300    


%chk=000158315-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158315

0 1
O -4.505910 0.993337 -0.792087
O 4.576256 1.300349 0.918744
O -4.601848 0.796212 1.864703
C -3.832717 -0.243214 -0.284126
C -2.323713 0.005376 -0.154846
C 4.347879 0.102396 0.068533
C 2.837855 -0.191322 -0.047462
C 0.029615 -0.732469 -0.348641
C 0.486734 0.545169 0.151348
C -1.375901 -0.970462 -0.490426
C 1.892821 0.785651 0.286661
C -1.858324 1.273110 0.344991
C -4.526317 -0.442831 1.102322
C -0.496163 1.531746 0.491248
C 2.373835 -1.455987 -0.550395
C 1.011611 -1.717772 -0.695862
C -4.195665 -1.423746 -1.205206
C 5.133569 -1.084840 0.676831
C 4.919534 0.509272 -1.306494
H -1.694013 -1.946642 -0.873883
H 2.239124 1.761525 0.645142
H -2.594472 2.030062 0.626229
H -5.543243 -0.853311 0.921787
H -3.949443 -1.153044 1.716475
H -0.160251 2.501587 0.877452
H 3.099701 -2.229410 -0.824980
H 0.677042 -2.689148 -1.080389
H -3.672932 -1.357980 -2.176162
H -3.942591 -2.395547 -0.741757
H -5.282571 -1.407421 -1.392708
H 4.715032 -1.378278 1.658001
H 5.115675 -1.974304 0.023031
H 6.186209 -0.783749 0.816882
H 4.408369 1.416527 -1.669662
H 5.998462 0.724363 -1.216055
H 4.771989 -0.297706 -2.045176
H -4.001295 1.339424 -1.569977
H 4.284273 1.085233 1.842803
H -4.936219 1.481540 1.225711


