%chk=000072415.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072415

0 1
 O    1.725100       1.565200      -1.082100    
 O  -0.6297000       1.497300      0.3683000    
 O   -1.497700       1.194100       1.499900    
 O    3.473700      5.9000002E-03 -0.7460000    
 C   0.8739000     -0.3328000      0.9485000    
 C  -9.8600000E-02  0.2388000     -0.1172000    
 C    1.316900      -1.776900      0.6477000    
 C   0.1106000      -2.699100      0.4270000    
 C    2.077800      0.6120000       1.140100    
 C   -1.205800     -0.7586000     -0.4855000    
 C  -0.7493000      -2.180300     -0.7319000    
 C   0.6904000      0.6250000      -1.382900    
 C    2.719700       1.076400     -0.1787000    
 C   -2.517600     -0.4568000     -0.5823000    
 C   0.5730000      -4.129900      0.1527000    
 C   -3.103300      0.9161000     -0.3679000    
 C    3.679600       2.235900      9.9799998E-02
 C   -2.835500       1.423800       1.057200    
 C   -4.603400      0.9440000     -0.6668000    
 H   0.3583000     -0.3683000       1.918800    
 H    1.959600      -1.817700     -0.2372000    
 H    1.916800      -2.152200       1.486500    
 H  -0.4953000      -2.710700       1.343200    
 H    1.711600       1.493700       1.683200    
 H    2.826800      0.1301000       1.780700    
 H   -1.607300      -2.850700     -0.8687000    
 H  -0.1819000      -2.214900      -1.670500    
 H    1.128600     -0.2389000      -1.894900    
 H   2.8200001E-02   1.123700      -2.100600    
 H   -3.216400      -1.247900     -0.8470000    
 H  -0.2856000      -4.796900      2.2100000E-02
 H    1.185400      -4.184600     -0.7538000    
 H    1.169400      -4.511900      0.9878000    
 H   -2.626200       1.593600      -1.089100    
 H    4.491400       1.929500      0.7679000    
 H    4.139500       2.587100     -0.8315000    
 H    3.155400       3.092000      0.5380000    
 H   -3.038200       2.498800       1.122700    
 H   -3.494800      0.9235000       1.775600    
 H    4.165300      0.3836000      -1.314600    
 H   -4.803500      0.6283000      -1.696800    
 H   -5.158800      0.2777000      2.9000000E-03
 H   -5.003400       1.956400     -0.5444000    


%chk=000072415-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072415

0 1
O 1.827712 1.593516 -1.117173
O -0.613304 1.550181 0.369340
O -1.535221 1.221705 1.549304
O 3.503074 -0.077334 -0.679907
C 0.895975 -0.336043 0.957989
C -0.068217 0.242595 -0.125767
C 1.327226 -1.796087 0.666766
C 0.119448 -2.729489 0.428666
C 2.092093 0.629579 1.167298
C -1.180784 -0.741698 -0.504982
C -0.718189 -2.172585 -0.754562
C 0.714241 0.675995 -1.394703
C 2.793857 1.091773 -0.124411
C -2.501112 -0.415011 -0.606830
C 0.564865 -4.182393 0.164080
C -3.150034 0.945063 -0.373635
C 3.760438 2.259694 0.091041
C -2.913270 1.456262 1.068523
C -4.667896 0.907118 -0.667094
H 0.308840 -0.342584 1.897790
H 2.005431 -1.825164 -0.206373
H 1.919786 -2.159563 1.530104
H -0.523487 -2.714138 1.334831
H 1.723432 1.539567 1.672550
H 2.845341 0.153726 1.821515
H -1.597576 -2.817450 -0.941709
H -0.084121 -2.225300 -1.666820
H 1.089471 -0.232591 -1.904940
H 0.052560 1.234581 -2.076171
H -3.193482 -1.228043 -0.874801
H -0.303767 -4.851148 0.015093
H 1.197863 -4.241207 -0.742469
H 1.155350 -4.577750 1.011453
H -2.681714 1.683750 -1.051147
H 4.558643 1.967023 0.794011
H 4.218219 2.558084 -0.870244
H 3.223851 3.134033 0.494184
H -3.158599 2.535302 1.135928
H -3.520860 0.891446 1.804159
H 4.009974 0.230855 -1.475689
H -4.853919 0.641645 -1.723278
H -5.176924 0.156420 -0.032722
H -5.140512 1.889064 -0.478998


