%chk=000122521.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122521

0 1
 O   -1.653200      -1.704900      0.6897000    
 O   -1.504900      -1.096900      -1.519500    
 O    3.066600     -0.8595000     -0.5756000    
 O    2.946300      0.5737000       1.224200    
 C   -2.159700      0.5753000      0.1251000    
 C   -1.146900       1.647800     -0.3700000    
 C   0.3309000       1.517600      7.4299999E-02
 C   0.9917000      0.1517000     -0.1755000    
 C   -2.377500      0.6716000       1.644300    
 C   -3.518700      0.8354000     -0.5612000    
 C    1.161500       2.654600     -0.5393000    
 C   -1.727200     -0.8207000     -0.3448000    
 C    2.434600      1.3800000E-02  0.2658000    
 C   -1.286300      -3.043500      0.3408000    
 C    4.442700      -1.115800     -0.2782000    
 H   -1.513600       2.639800     -7.1699999E-02
 H   -1.155100       1.647000      -1.469600    
 H   0.3503000       1.685200       1.160000    
 H   0.4991000     -0.6260000      0.4046000    
 H   0.9281000     -8.6800002E-02  -1.243400    
 H   -1.460300      0.4367000       2.195100    
 H   -3.151200     -2.6200000E-02   1.985100    
 H   -2.690600       1.680800       1.934700    
 H   -3.432600      0.8035000      -1.653700    
 H   -3.918700       1.818300     -0.2879000    
 H   -4.257900      7.8500003E-02 -0.2732000    
 H   0.6925000       3.625300     -0.3454000    
 H    2.171200       2.696200     -0.1207000    
 H    1.247900       2.532800      -1.624400    
 H   -1.244400      -3.634400       1.259600    
 H  -0.2988000      -3.058000     -0.1304000    
 H   -2.038200      -3.479700     -0.3235000    
 H    4.538400      -1.563500      0.7155000    
 H    5.022900     -0.1905000     -0.3435000    
 H    4.824700      -1.822600      -1.019700    


%chk=000122521-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122521

0 1
O -1.833758 -1.867458 0.570129
O -1.860412 -1.142732 -1.634877
O 3.279227 -0.716785 -0.414057
O 2.835606 0.701426 1.377152
C -2.122618 0.537984 0.169565
C -1.123736 1.525817 -0.524682
C 0.353841 1.528134 -0.048730
C 1.041912 0.151469 -0.243362
C -2.008335 0.588934 1.710618
C -3.570234 0.944356 -0.258511
C 1.126914 2.638329 -0.801954
C -1.915336 -0.872616 -0.411475
C 2.441974 0.111676 0.343768
C -1.688390 -3.254801 0.061813
C 4.663651 -0.868197 0.098079
H -1.523288 2.547897 -0.365795
H -1.158205 1.335457 -1.615984
H 0.387837 1.765850 1.032348
H 0.466862 -0.640545 0.277748
H 1.082215 -0.131841 -1.309771
H -1.033338 0.222282 2.072158
H -2.789887 -0.027308 2.186331
H -2.131680 1.634263 2.050583
H -3.664551 0.958162 -1.358275
H -3.799539 1.952510 0.131349
H -4.318837 0.240306 0.148676
H 0.647780 3.623014 -0.648497
H 2.168734 2.714920 -0.443635
H 1.145777 2.437616 -1.890512
H -1.681767 -3.883267 0.963320
H -0.746258 -3.357058 -0.503079
H -2.532949 -3.509867 -0.599816
H 4.652139 -1.295855 1.114885
H 5.169045 0.111828 0.125919
H 5.153202 -1.547301 -0.613830


