%chk=000087085.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087085

0 1
 O    1.653600      0.1975000     -0.3559000    
 O    3.488000     -3.1000001E-03   1.033900    
 C  -0.6542000      0.1753000      0.3590000    
 C   -1.373400     -0.9740000      3.1800002E-02
 C   0.7810000      9.4400004E-02  0.7643000    
 C   -1.274500       1.423700      0.3104000    
 C   -2.713100     -0.8751000     -0.3442000    
 C  -0.7307000      -2.321400      7.6200001E-02
 C   -2.614100       1.522700     -6.5399997E-02
 C   -3.333400      0.3734000     -0.3928000    
 C    2.989600      0.1329000     -7.5199999E-02
 C    3.781200      0.2537000      -1.342000    
 H    1.003700      0.9151000       1.459800    
 H   0.9881000     -0.8298000       1.316500    
 H  -0.7259000       2.328100      0.5600000    
 H   -3.288400      -1.760500     -0.6013000    
 H   0.1955000      -2.334500     -0.5078000    
 H  -0.5175000      -2.611100       1.110200    
 H   -1.382100      -3.092100     -0.3510000    
 H   -3.097100       2.494800     -0.1039000    
 H   -4.376400      0.4506000     -0.6854000    
 H    3.574900       1.215900      -1.817300    
 H    3.530900     -0.5701000      -2.015100    
 H    4.848600      0.2017000      -1.109200    


%chk=000087085-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000087085

0 1
O 1.681149 0.541817 -0.241783
O 3.011790 -1.004045 0.908099
C -0.692779 0.444336 0.436692
C -1.172066 -0.820768 -0.023698
C 0.726596 0.619746 0.921828
C -1.569545 1.557015 0.469499
C -2.525626 -0.920563 -0.431456
C -0.266525 -2.036766 -0.109223
C -2.915693 1.441496 0.060568
C -3.395106 0.192884 -0.392852
C 2.791364 -0.301244 -0.105143
C 3.667711 -0.211688 -1.336352
H 0.876399 1.621947 1.357402
H 1.036036 -0.148332 1.653729
H -1.190547 2.524967 0.820510
H -2.902823 -1.888943 -0.782060
H 0.395090 -1.972641 -0.994549
H 0.394529 -2.136367 0.770292
H -0.856916 -2.964284 -0.200873
H -3.579815 2.311848 0.095595
H -4.437862 0.084736 -0.711980
H 4.307213 0.687108 -1.266022
H 3.055876 -0.115534 -2.247170
H 4.315850 -1.098625 -1.395452


