%chk=000066400.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066400

0 1
 O    4.509700      0.8191000      -1.697500    
 O    3.858200      -3.629100      0.9245000    
 O   -5.902300     -9.5299996E-02 -0.2679000    
 C    2.814900     -0.2071000     -0.2201000    
 C    1.928600      0.8603000      0.5025000    
 C   0.4729000      0.9626000      6.6600002E-02
 C    4.216400      0.4718000     -0.3460000    
 C    2.679800       2.178100      0.3161000    
 C    4.132100       1.757200      0.4742000    
 C    2.926500      -1.452400      0.6812000    
 C    2.261500     -0.6569000      -1.583000    
 C  -0.2367000       2.110100      0.7912000    
 C  -0.2667000     -0.3565000      0.3350000    
 C   -1.657700       2.284200      0.2569000    
 C   -1.761000     -0.2546000      0.1515000    
 C    3.814800      -2.507300      5.3800002E-02
 C   -2.420200      0.9878000      0.1550000    
 C   -2.513700      -1.433000      3.2099999E-02
 C   -3.814700       1.028300      2.4000001E-03
 C   -3.899900      -1.380000     -0.1087000    
 C   -4.550000     -0.1496000     -0.1259000    
 C   -6.592600      -1.337800     -0.3940000    
 H    1.940900      0.6512000       1.583400    
 H   0.4170000       1.188600      -1.005800    
 H    5.048900     -0.1325000      2.0000000E-02
 H    2.421800       2.929500       1.068200    
 H    2.506200       2.602900     -0.6797000    
 H    4.812400       2.539500      0.1244000    
 H    4.346200       1.548800       1.529200    
 H    1.944900      -1.892300      0.8888000    
 H    3.335500      -1.184100       1.664700    
 H    1.479600      -1.413400      -1.536900    
 H    1.901100      0.1895000      -2.176200    
 H    3.051700      -1.115400      -2.191700    
 H   0.2789000       3.066100      0.6585000    
 H  -0.2687000       1.908100       1.870100    
 H  -9.6900001E-02 -0.6643000       1.375700    
 H   7.3899999E-02  -1.170100     -0.2972000    
 H   -1.616600       2.733700     -0.7434000    
 H   -2.195300       2.981500      0.9107000    
 H    3.418800      -2.869600     -0.8982000    
 H    4.843500      -2.175700     -9.8700002E-02
 H    5.378500       1.255900      -1.706600    
 H   -2.019800      -2.401700      4.8799999E-02
 H   -4.330200       1.986000     -1.6300000E-02
 H    4.425300      -4.297600      0.5035000    
 H   -4.408200      -2.333900     -0.1987000    
 H   -6.485800      -1.950600      0.5075000    
 H   -6.291500      -1.875400      -1.299500    
 H   -7.657700      -1.106500     -0.4989000    


%chk=000066400-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066400

0 1
O 4.445185 1.083013 -1.756783
O 4.159266 -3.609052 1.012561
O -6.021649 -0.031765 -0.344221
C 2.916963 -0.200125 -0.266071
C 1.960048 0.816639 0.523700
C 0.470550 0.887920 0.080093
C 4.292733 0.568598 -0.375057
C 2.717983 2.171929 0.497409
C 4.192129 1.742604 0.622162
C 3.125104 -1.475088 0.612646
C 2.397001 -0.578295 -1.676460
C -0.270161 2.110923 0.684430
C -0.314843 -0.386925 0.489479
C -1.686314 2.255448 0.087334
C -1.818603 -0.301119 0.238488
C 3.888648 -2.624962 -0.054973
C -2.479238 0.952369 0.085094
C -2.594309 -1.482374 0.182742
C -3.877580 0.986808 -0.104903
C -3.993482 -1.457836 -0.009335
C -4.637243 -0.204193 -0.151641
C -6.846743 -1.238543 -0.395455
H 1.955405 0.481939 1.586565
H 0.427629 0.995185 -1.023617
H 5.148523 -0.101327 -0.148580
H 2.404163 2.849731 1.310249
H 2.557338 2.691106 -0.467597
H 4.917486 2.548853 0.402075
H 4.395602 1.382464 1.650461
H 2.143089 -1.862015 0.942612
H 3.676158 -1.201159 1.535253
H 1.490601 -1.206651 -1.613906
H 2.167736 0.319684 -2.271327
H 3.165366 -1.133766 -2.240879
H 0.292282 3.041767 0.489707
H -0.331228 1.990010 1.786238
H -0.137269 -0.558298 1.574392
H 0.085071 -1.279600 -0.026292
H -1.595151 2.615397 -0.959330
H -2.252685 3.036325 0.630856
H 3.280830 -3.084764 -0.861068
H 4.841177 -2.263280 -0.499360
H 5.261414 1.643693 -1.785463
H -2.093244 -2.452668 0.294284
H -4.402561 1.941774 -0.221567
H 4.602938 -4.403129 0.620590
H -4.554604 -2.396356 -0.045758
H -6.785683 -1.811597 0.550873
H -6.555898 -1.892815 -1.241080
H -7.875635 -0.878376 -0.543965


