%chk=000089049.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089049

0 1
 O   0.6856000     -0.7064000      0.8534000    
 O    3.429200       2.121300     -0.4478000    
 O    3.560100     -0.6209000      -1.430500    
 O  -0.6544000      0.7195000     -0.4894000    
 O    1.955800       1.670700       1.851000    
 O   0.8243000      -3.370200      0.2591000    
 C    2.317700       1.231400     -0.5045000    
 C    2.780700     -0.2135000     -0.3091000    
 C    1.311500       1.630100      0.5764000    
 C    1.566900      -1.143200     -0.1845000    
 C   0.1716000      0.6168000      0.6654000    
 C    1.988200      -2.571700      0.1483000    
 C   -1.979900      0.4148000     -0.3278000    
 C   -2.347100     -0.8547000      0.1050000    
 C   -2.945800       1.377900     -0.5985000    
 C   -3.697100      -1.165100      0.2688000    
 C   -4.295800       1.067400     -0.4345000    
 C   -4.671400     -0.2042000     -7.9999998E-04
 H    1.871400       1.347700      -1.499100    
 H    3.418000     -0.2764000      0.5818000    
 H   0.9222000       2.634200      0.3714000    
 H    1.004800      -1.173100      -1.127500    
 H  -0.4158000      0.8469000       1.564800    
 H    2.511600      -2.609500       1.109500    
 H    2.626800      -3.000200     -0.6292000    
 H    3.933100       1.927500      0.3605000    
 H    4.033300      -1.433400      -1.184900    
 H    2.590200       2.407100       1.833800    
 H    1.114300      -4.272100      0.4782000    
 H   -1.608600      -1.624300      0.3032000    
 H   -2.657500       2.369200     -0.9362000    
 H   -3.990000      -2.156400      0.6022000    
 H   -5.054600       1.815500     -0.6447000    
 H   -5.722500     -0.4462000      0.1258000    


%chk=000089049-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089049

0 1
O 0.684997 -0.732780 0.958534
O 3.478980 2.187718 -0.197386
O 3.617669 -0.354886 -1.414801
O -0.661322 0.971088 -0.124693
O 2.127879 1.646053 2.124240
O 0.702378 -3.332697 -0.578733
C 2.319758 1.292119 -0.305079
C 2.764847 -0.175526 -0.222543
C 1.389720 1.664155 0.861971
C 1.518814 -1.093281 -0.218535
C 0.240494 0.647087 0.986374
C 1.841996 -2.574535 -0.054958
C -1.986939 0.468148 -0.081789
C -2.400949 -0.593208 0.757833
C -2.898685 1.100033 -0.958580
C -3.754955 -0.998958 0.725280
C -4.243233 0.674732 -0.985417
C -4.680802 -0.372509 -0.138971
H 1.793006 1.442061 -1.268901
H 3.344954 -0.336580 0.710215
H 0.956381 2.666325 0.675886
H 0.941448 -0.946474 -1.152869
H -0.273888 0.749927 1.958180
H 2.022362 -2.778814 1.020406
H 2.761755 -2.827637 -0.630266
H 4.157967 1.864351 -0.844217
H 4.099029 -1.217451 -1.364199
H 2.980115 2.126566 1.943900
H 0.710724 -4.251273 -0.211806
H -1.677868 -1.118968 1.386717
H -2.543439 1.915464 -1.596341
H -4.080047 -1.821710 1.372133
H -4.950168 1.166284 -1.663082
H -5.726179 -0.698326 -0.158905


