%chk=000177022.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000177022

0 1
 O   -1.764200      -1.507800      -1.238200    
 O    2.414900      -2.335200     -0.2779000    
 O   -3.255900      8.4700003E-02  -1.858600    
 O   -3.459600       2.381700     -8.2999997E-02
 C   0.9408000     -0.4172000     -0.3498000    
 C  -0.1676000      -1.022700      0.4934000    
 C    2.762400       1.212300     -0.3003000    
 C    1.298500      0.9939000      0.1264000    
 C    3.417900     -0.1548000     -3.6100000E-02
 C    2.273000      -1.119300     -0.2326000    
 C   -1.219100     -6.1000001E-02  0.9543000    
 C  -0.9004000      -2.126600     -0.2280000    
 C   0.1503000      -1.076200       1.975900    
 C  -0.6170000      1.3800000E-02   2.248100    
 C    3.419600       2.314400      0.5355000    
 C    2.858400       1.586600      -1.789300    
 C   -2.307600      0.3290000      0.2978000    
 C   -2.477600     -0.3541000      -1.016800    
 C   -3.366800       1.258500      0.7791000    
 H   0.6760000     -0.3821000      -1.413800    
 H   0.6316000       1.748100     -0.3085000    
 H    1.271800       1.127100       1.210700    
 H    3.766100     -0.2510000      0.9974000    
 H    4.231800     -0.3756000     -0.7316000    
 H  -0.2242000      -2.812300     -0.7476000    
 H   -1.543400      -2.725000      0.4287000    
 H   0.8420000      -1.669900       2.564900    
 H  -0.8273000      0.5907000       3.141700    
 H    3.384100       2.083300       1.606100    
 H    4.472800       2.440300      0.2608000    
 H    2.914300       3.275100      0.3864000    
 H    2.323000       2.520600      -1.993400    
 H    3.902800       1.729000      -2.089500    
 H    2.435800      0.8132000      -2.438900    
 H   -3.153200       1.620100       1.790300    
 H   -4.336700      0.7504000      0.7961000    
 H   -4.168000       2.950700      0.2633000    


%chk=000177022-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177022

0 1
O -1.556966 -1.516904 -1.320897
O 2.325632 -2.332793 0.057141
O -3.188255 -0.107516 -2.113374
O -3.499223 1.930572 1.700707
C 0.946203 -0.273714 -0.202140
C -0.212831 -0.890961 0.624814
C 2.861921 1.282336 -0.419124
C 1.388171 1.177330 0.108121
C 3.444415 -0.118571 -0.066615
C 2.255761 -1.084799 -0.068629
C -1.399866 0.043319 0.989920
C -0.843809 -2.080413 -0.116238
C 0.001237 -0.908828 2.162713
C -0.987593 0.029402 2.409453
C 3.630544 2.429355 0.272361
C 2.875776 1.498221 -1.956138
C -2.480843 0.248032 0.183317
C -2.454183 -0.427428 -1.150562
C -3.709189 1.064878 0.534339
H 0.645625 -0.333896 -1.270991
H 0.731358 1.929060 -0.363303
H 1.373025 1.354057 1.201319
H 3.875512 -0.123960 0.956375
H 4.241178 -0.468325 -0.747342
H -0.114471 -2.788379 -0.534140
H -1.582729 -2.607315 0.515306
H 0.683339 -1.480309 2.796199
H -1.401155 0.493275 3.304971
H 3.643240 2.298126 1.370987
H 4.678915 2.475121 -0.077324
H 3.161136 3.407065 0.053073
H 2.382288 2.451427 -2.221922
H 3.913986 1.537812 -2.334916
H 2.354239 0.687000 -2.496765
H -4.547918 0.406943 0.823835
H -4.034337 1.635803 -0.359753
H -2.800832 2.597674 1.478223


