%chk=000176813.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176813

0 1
 O  -0.4668000      -1.900500      5.9599999E-02
 O   -2.057900      -3.457600     -0.5667000    
 O    3.558700       1.057100     -0.5688000    
 C   -2.669200      1.1500000E-02 -0.3300000    
 C   -3.778500     -0.9461000     -0.7239000    
 C   -2.737300      -1.365000      0.2755000    
 C   -3.322800       1.210400      0.3300000    
 C   -5.013800     -0.2788000     -0.2854000    
 C   -4.806200      0.9162000      0.2951000    
 C   -1.732800      -2.364100     -0.1269000    
 C   -5.811100       1.856000      0.8474000    
 C   0.5789000      -2.807100     -0.3050000    
 C    1.905100      -2.156000     -4.3200001E-02
 C    2.113900     -0.8380000     -0.4334000    
 C    2.912800      -2.876700      0.5878000    
 C    3.346600     -0.2328000     -0.1895000    
 C    4.145500      -2.271400      0.8316000    
 C    4.362500     -0.9495000      0.4430000    
 C    2.565300       1.981100     -0.2915000    
 C    1.972400       1.978500      0.9581000    
 C    2.191400       2.882800      -1.271500    
 C   0.9717000       2.909300       1.237300    
 C    1.190800       3.813600     -0.9922000    
 C   0.5809000       3.826900      0.2622000    
 H   -1.905200      0.2567000      -1.053500    
 H   -3.767200      -1.349700      -1.727500    
 H   -3.047700      -1.444400       1.312900    
 H   -3.100900       2.122100     -0.2344000    
 H   -2.965500       1.326500       1.358200    
 H   -5.988600     -0.7245000     -0.4303000    
 H   -5.630500       2.024000       1.913500    
 H   -6.828600       1.468300      0.7341000    
 H   -5.757200       2.818900      0.3301000    
 H   0.5032000      -3.053900      -1.370800    
 H   0.4727000      -3.724100      0.2867000    
 H    1.325500     -0.3006000     -0.9545000    
 H    2.757200      -3.907400      0.8942000    
 H    4.936700      -2.829300       1.323900    
 H    5.324700     -0.4832000      0.6359000    
 H    2.274600       1.290200       1.741900    
 H    2.664800       2.873300      -2.248500    
 H   0.4996000       2.922600       2.215400    
 H   0.8863000       4.527900      -1.751500    
 H  -0.1980000       4.551800      0.4798000    


%chk=000176813-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176813

0 1
O -0.750916 -2.428751 0.009322
O -0.914253 -0.823671 -1.692146
O 3.738159 0.893897 -0.175109
C -2.928293 0.587605 0.040709
C -3.775979 -0.379798 -0.788674
C -2.586334 -0.925120 0.082129
C -3.824261 1.132831 1.160918
C -5.109243 -0.432719 -0.106781
C -5.148247 0.373731 0.996178
C -1.364410 -1.345591 -0.637855
C -6.283735 0.541363 1.971964
C 0.524113 -2.937246 -0.614236
C 1.737141 -2.285474 0.014397
C 2.122522 -0.981140 -0.386117
C 2.494546 -2.973543 0.994816
C 3.246128 -0.375694 0.217167
C 3.631275 -2.361932 1.571222
C 4.011984 -1.058451 1.189049
C 2.855464 1.942155 -0.546239
C 1.591704 2.134279 0.059462
C 3.356149 2.859119 -1.496091
C 0.820974 3.258884 -0.309938
C 2.575625 3.980645 -1.851090
C 1.304529 4.184528 -1.263762
H -2.186631 1.228437 -0.443181
H -3.664139 -0.467613 -1.872039
H -2.843181 -1.499470 0.975414
H -3.983661 2.224229 1.040256
H -3.387538 0.987746 2.169216
H -5.928850 -1.072302 -0.447274
H -5.993494 0.210408 2.988871
H -7.171995 -0.038694 1.668085
H -6.581676 1.604920 2.060096
H 0.469254 -2.741009 -1.699177
H 0.491954 -4.018862 -0.411269
H 1.546300 -0.459117 -1.157210
H 2.195222 -3.981436 1.304421
H 4.220367 -2.897517 2.323381
H 4.885229 -0.562127 1.622547
H 1.220348 1.426049 0.806533
H 4.341506 2.681232 -1.937043
H -0.157822 3.414059 0.158511
H 2.960151 4.692819 -2.589471
H 0.700013 5.053341 -1.544763


