%chk=000095541.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095541

0 1
 O    3.363600      -1.090000      0.2924000    
 O   -1.680500     -0.1206000     -0.2116000    
 O   -3.097200       1.482000      0.6526000    
 C    3.223500      0.1092000     -0.4880000    
 C    4.489800      0.9152000     -0.2561000    
 C    1.958100      0.8410000     -8.4899999E-02
 C    5.516700     -0.1778000     -9.7199999E-02
 C    4.741200      -1.226300      0.6717000    
 C   0.7136000      5.9000002E-03 -0.3721000    
 C  -0.5562000      0.7189000      7.0799999E-02
 C   -3.971200     -0.6107000     -0.2263000    
 C   -2.898700      0.3918000      0.1346000    
 C   -5.365100     -0.1187000      0.1554000    
 C   -6.437600      -1.120000     -0.2413000    
 H    3.167100     -0.1961000      -1.540600    
 H    4.711700       1.604100      -1.075800    
 H    4.423700       1.495300      0.6724000    
 H    1.893700       1.795600     -0.6203000    
 H    1.988200       1.065400      0.9889000    
 H    6.426100      0.1433000      0.4173000    
 H    5.799300     -0.5684000      -1.082000    
 H    5.083700      -2.242600      0.4578000    
 H    4.807000      -1.055200       1.751300    
 H   0.6474000     -0.2221000      -1.443300    
 H   0.7699000     -0.9643000      0.1368000    
 H  -0.6659000       1.665200     -0.4718000    
 H  -0.5193000      0.9214000       1.147600    
 H   -3.923100     -0.7858000      -1.307000    
 H   -3.754700      -1.548400      0.2977000    
 H   -5.570200      0.8416000     -0.3329000    
 H   -5.415700      5.9000000E-02   1.236300    
 H   -6.280200      -2.081500      0.2578000    
 H   -6.435500      -1.289400      -1.322800    
 H   -7.427000     -0.7480000      4.2199999E-02


%chk=000095541-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095541

0 1
O 3.436956 -1.165219 0.158745
O -1.701672 -0.136556 -0.197622
O -3.095846 1.421341 0.832511
C 3.270041 0.118566 -0.595676
C 4.580483 0.914758 -0.372182
C 1.997136 0.831883 -0.112888
C 5.626042 -0.187750 -0.068204
C 4.793923 -1.190460 0.756069
C 0.717373 0.013560 -0.397046
C -0.522949 0.708194 0.162378
C -4.053091 -0.613096 -0.217972
C -2.951325 0.345049 0.207278
C -5.464534 -0.118007 0.154962
C -6.558511 -1.112873 -0.285163
H 3.160269 -0.160225 -1.665095
H 4.847469 1.530756 -1.247588
H 4.469685 1.585808 0.501345
H 1.934650 1.822107 -0.611743
H 2.096254 1.019967 0.975165
H 6.504208 0.191690 0.482164
H 5.974525 -0.657182 -1.006077
H 5.160302 -2.229671 0.699323
H 4.739601 -0.881758 1.821276
H 0.594738 -0.128177 -1.488483
H 0.822600 -0.989778 0.052783
H -0.672393 1.717286 -0.266614
H -0.485556 0.807080 1.263496
H -3.965747 -0.775432 -1.310219
H -3.846670 -1.598623 0.244633
H -5.638805 0.870461 -0.309755
H -5.515606 0.047410 1.247200
H -6.420740 -2.099882 0.195850
H -6.542901 -1.268609 -1.380680
H -7.563709 -0.743617 -0.012569


