%chk=000090797.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090797

0 1
 O    2.431700      -3.560900      -1.089700    
 O    3.095600     -0.5808000      0.5787000    
 O   0.7157000     -0.4487000       1.780000    
 C    3.152200      -2.873700     -6.3900001E-02
 C    1.710100      -3.235400      0.1053000    
 C    3.555500      -1.485000     -0.4235000    
 C    2.810900      0.6913000      0.1808000    
 C    1.530100       1.220900      0.3381000    
 C  -0.9986000      0.6736000      0.5106000    
 C   -1.865100     -0.5866000      0.5676000    
 C   0.4614000      0.4293000      0.9315000    
 C   -3.283000     -0.3076000      0.1404000    
 C    3.821000       1.466500     -0.3889000    
 C    1.259500       2.525700     -7.4199997E-02
 C    3.550400       2.771400     -0.8010000    
 C    2.269800       3.300900     -0.6438000    
 C   -4.219100      7.3299997E-02   1.090700    
 C   -3.630300     -0.4356000      -1.196600    
 C   -5.531600      0.3318000      0.6953000    
 C   -4.942800     -0.1769000      -1.591800    
 C   -5.893400      0.2068000     -0.6458000    
 H    3.891700      -3.414400      0.5098000    
 H    1.463000      -4.048300      0.7757000    
 H   0.9517000      -2.470200      2.2000000E-02
 H    3.147000      -1.212900      -1.406000    
 H    4.648100      -1.425800     -0.4811000    
 H   -1.013100       1.059700     -0.5157000    
 H   -1.406400       1.448700       1.170700    
 H   -1.862500      -1.004400       1.582700    
 H   -1.430800      -1.369100     -6.8000004E-02
 H    4.826000       1.071500     -0.5097000    
 H   0.2777000       2.973900      5.0600000E-02
 H    4.337700       3.376000      -1.241700    
 H    2.060600       4.318500     -0.9606000    
 H   -3.946700      0.1754000       2.137300    
 H   -2.896700     -0.7320000      -1.941000    
 H   -6.271600      0.6312000       1.431800    
 H   -5.224600     -0.2737000      -2.636300    
 H   -6.915200      0.4084000     -0.9537000    


%chk=000090797-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090797

0 1
O 5.373629 -3.695517 0.210146
O 2.787648 -0.981582 0.142982
O 0.192885 -1.237059 0.779415
C 4.109459 -2.926705 0.515011
C 4.084007 -3.996019 -0.527977
C 4.181909 -1.465490 0.130654
C 2.547044 0.362038 -0.128537
C 1.182249 0.817174 -0.079093
C -1.394519 0.468686 0.094397
C -2.484129 -0.590262 0.391661
C 0.033307 -0.077407 0.299347
C -3.880570 -0.017802 0.198165
C 3.590889 1.264750 -0.465080
C 0.937788 2.184288 -0.393515
C 3.303633 2.612519 -0.757556
C 1.971392 3.080401 -0.725358
C -4.568719 0.602686 1.273329
C -4.513254 -0.057496 -1.071769
C -5.849506 1.170620 1.086454
C -5.793965 0.508146 -1.264754
C -6.466809 1.126801 -0.185318
H 3.670710 -3.136303 1.497568
H 3.633021 -4.965702 -0.289569
H 4.085067 -3.711362 -1.587444
H 4.632886 -1.351731 -0.875386
H 4.787397 -0.898851 0.866425
H -1.506486 0.846431 -0.941151
H -1.549105 1.345714 0.755886
H -2.346811 -0.958522 1.423834
H -2.321433 -1.460799 -0.269535
H 4.627990 0.920983 -0.504736
H -0.089609 2.557419 -0.366366
H 4.122779 3.293913 -1.012738
H 1.743561 4.126103 -0.953583
H -4.099957 0.631263 2.265324
H -4.000918 -0.543716 -1.911931
H -6.367342 1.640213 1.930802
H -6.268721 0.462115 -2.251721
H -7.461495 1.562860 -0.331685


