%chk=000041868.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041868

0 1
 O   -1.432600       2.110700     -0.3784000    
 O  -0.6456000      -1.773400       1.278800    
 O    5.462700      -1.428700     -0.5254000    
 O    3.365200      -1.575300      -1.371200    
 C    2.447300      0.6794000      6.2300000E-02
 C   5.2299999E-02  0.2446000      0.2869000    
 C    3.857500      0.2174000      0.2132000    
 C  -0.2052000       1.533700     -0.2012000    
 C    1.393700     -0.1628000      0.4233000    
 C   -2.387200     -0.6964000      0.2040000    
 C   -3.083600      0.5146000      0.2094000    
 C  -0.9757000     -0.7812000      0.6319000    
 C   -2.396800       1.778200      0.6131000    
 C    2.180500       1.941600     -0.4498000    
 C   0.8607000       2.363200     -0.5854000    
 C    4.260300     -9.7400002E-02   1.668200    
 C   -3.039600      -1.882100     -0.1623000    
 C   -4.431700      0.5291000     -0.1762000    
 C    4.175200      -1.010200     -0.6478000    
 C   -4.380700      -1.855200     -0.5426000    
 C   -5.076500     -0.6498000     -0.5509000    
 H    4.527800       1.008300     -0.1508000    
 H    1.626100      -1.156800      0.8006000    
 H   -3.111700       2.608200      0.6538000    
 H   -1.960800       1.707300       1.618900    
 H    2.983600       2.610700     -0.7455000    
 H   0.6630000       3.357300     -0.9808000    
 H    4.012200      0.7411000       2.328300    
 H    3.746800     -0.9886000       2.046100    
 H    5.337100     -0.2790000       1.752300    
 H   -2.514000      -2.833700     -0.1641000    
 H   -4.991300       1.461300     -0.1860000    
 H   -4.882000      -2.774400     -0.8315000    
 H   -6.121100     -0.6269000     -0.8471000    
 H    5.644400      -2.217300      -1.079800    


%chk=000041868-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041868

0 1
O -1.354099 2.242244 -0.354618
O -0.635067 -1.741448 1.489737
O 4.726115 -0.623912 -1.752851
O 3.988585 -2.262452 -0.281130
C 2.523568 0.625479 0.202441
C 0.066762 0.312238 0.453059
C 3.961909 0.126845 0.417131
C -0.131960 1.584430 -0.174362
C 1.416296 -0.117977 0.643493
C -2.382506 -0.653583 0.282444
C -3.108953 0.558186 0.122505
C -0.976591 -0.714272 0.818878
C -2.476081 1.861107 0.538821
C 2.284813 1.848755 -0.482372
C 0.977610 2.322368 -0.660564
C 4.254983 -0.278904 1.879883
C -3.003229 -1.886799 -0.047336
C -4.429250 0.521552 -0.381722
C 4.212239 -1.057002 -0.520011
C -4.317213 -1.915515 -0.556589
C -5.033959 -0.707429 -0.727391
H 4.650719 0.931259 0.105076
H 1.547275 -1.093042 1.125251
H -3.182037 2.701405 0.450887
H -2.087609 1.814274 1.576399
H 3.129971 2.434516 -0.861970
H 0.778408 3.282554 -1.145460
H 4.029160 0.561630 2.558221
H 3.645817 -1.147983 2.178792
H 5.316981 -0.556024 2.004412
H -2.435441 -2.809450 0.107360
H -4.987188 1.458286 -0.496896
H -4.781758 -2.872055 -0.818506
H -6.056628 -0.724107 -1.119609
H 4.828657 -1.407672 -2.359105


