%chk=000066394.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066394

0 1
 O    2.852000      -1.723100      3.8500000E-02
 O    5.082700       1.045800      0.3139000    
 O   -5.837400      0.1287000      0.4609000    
 C    2.664600      0.6028000      0.1364000    
 C    1.993200     -0.6651000     -0.3926000    
 C   0.5301000     -0.7603000      2.3300000E-02
 C  -0.2358000      0.4493000     -0.5876000    
 C    1.970500       1.811300     -0.4946000    
 C   0.4504000       1.796500     -0.2277000    
 C    4.083100      0.2998000     -0.3487000    
 C  -0.1235000      -2.060300     -0.4472000    
 C    4.200600      -1.204000     -6.4599998E-02
 C    2.647700      0.7350000       1.681300    
 C   -1.726000      0.3693000     -0.2706000    
 C   -1.539700      -2.157100      0.1133000    
 C   -2.331800     -0.8751000      1.4000000E-02
 C   -2.546800       1.508800     -0.3395000    
 C   -3.713100     -0.9388000      0.2685000    
 C   -3.918900       1.429500     -9.2500001E-02
 C   -4.501700      0.2070000      0.2156000    
 H    2.026800     -0.6824000      -1.493800    
 H   0.4579000     -0.7466000       1.118500    
 H  -0.1747000      0.3604000      -1.683700    
 H    2.130800       1.809800      -1.580700    
 H    2.402300       2.747000     -0.1202000    
 H   0.2543000       2.042100      0.8229000    
 H   1.2800000E-02   2.611200     -0.8165000    
 H    4.176100      0.4843000      -1.426300    
 H   0.4530000      -2.933500     -0.1211000    
 H  -0.1544000      -2.090300      -1.544100    
 H    4.714300      -1.722600     -0.8805000    
 H    4.731800      -1.423200      0.8671000    
 H    3.102100     -0.1291000       2.177100    
 H    3.202400       1.625500       1.998800    
 H    1.637200      0.8340000       2.086700    
 H   -1.484500      -2.435300       1.173700    
 H   -2.069400      -2.962300     -0.4103000    
 H    5.944600      0.7085000      1.6000001E-02
 H   -2.137200       2.481800     -0.5937000    
 H   -4.175100      -1.894200      0.5090000    
 H   -4.520300       2.333100     -0.1487000    
 H   -6.225400       1.017100      0.3806000    


%chk=000066394-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066394

0 1
O 2.864720 -1.778416 0.023353
O 5.120970 1.106423 0.347420
O -5.924300 0.093786 0.402549
C 2.684208 0.613942 0.141350
C 1.986347 -0.659175 -0.401884
C 0.532334 -0.785207 0.032303
C -0.222520 0.439780 -0.581602
C 1.973997 1.833725 -0.486720
C 0.444106 1.796430 -0.197667
C 4.120516 0.301149 -0.358507
C -0.144101 -2.091440 -0.426871
C 4.250850 -1.236819 -0.089734
C 2.686752 0.684040 1.689788
C -1.727581 0.366355 -0.273614
C -1.561498 -2.178254 0.171503
C -2.357113 -0.879429 0.038345
C -2.543932 1.522924 -0.352420
C -3.753046 -0.926863 0.256621
C -3.936602 1.478083 -0.133501
C -4.541282 0.237780 0.173306
H 2.007329 -0.617894 -1.520099
H 0.476925 -0.736456 1.138532
H -0.111263 0.337015 -1.687201
H 2.136933 1.830509 -1.585389
H 2.405305 2.776282 -0.099964
H 0.249535 2.006476 0.871782
H -0.028489 2.619636 -0.765778
H 4.175370 0.505871 -1.450578
H 0.460255 -2.961307 -0.113069
H -0.193229 -2.107562 -1.535131
H 4.778921 -1.770403 -0.903935
H 4.769154 -1.414491 0.870729
H 2.934768 -0.296759 2.131431
H 3.444812 1.413110 2.021116
H 1.707185 0.995433 2.088671
H -1.479412 -2.430376 1.249581
H -2.128580 -3.007148 -0.293466
H 6.005882 0.980193 -0.077232
H -2.091818 2.490287 -0.593356
H -4.245826 -1.876326 0.493399
H -4.537469 2.394356 -0.203520
H -6.383514 0.966039 0.320360


