%chk=000126221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126221

0 1
 O    2.999000      0.9114000      -1.741000    
 O   -5.293400       1.099000      0.8069000    
 O    5.274800     -0.6636000       1.087500    
 C  -0.1392000      0.2642000      0.4367000    
 C  -0.9795000     -0.7971000     -0.3412000    
 C   -2.420600     -0.7506000      0.1743000    
 C    1.368500      0.2794000     -4.4999998E-03
 C   -3.066200      0.6304000     -5.2499998E-02
 C  -0.8173000       1.664500      0.4364000    
 C   -2.311800       1.639300      0.8057000    
 C  -0.3627000      -2.187600     -0.1506000    
 C   -3.452700      -1.737000     -0.3626000    
 C    1.937200      -1.152400     -5.3599998E-02
 C    2.186800       1.098700       1.021700    
 C    1.069400      -2.224700     -0.6626000    
 C    1.608100      0.9309000      -1.388800    
 C   -4.478600      0.2886000      0.3861000    
 C   -4.771300      -1.191100      0.2050000    
 C    3.655100       1.057300      0.6288000    
 C   -3.161100       1.096500      -1.517000    
 C    3.186800      -1.458100      0.3417000    
 C    3.838700       1.582400     -0.7971000    
 C    4.130200     -0.3803000      0.7406000    
 H  -0.1480000     -5.9599999E-02   1.490500    
 H  -0.9659000     -0.5656000      -1.412500    
 H   -2.372200     -0.9404000       1.261000    
 H  -0.7132000       2.133900     -0.5466000    
 H  -0.3126000       2.325500       1.149200    
 H   -2.418300       1.389600       1.869500    
 H   -2.737700       2.643400      0.6890000    
 H  -0.9468000      -2.939100     -0.6943000    
 H  -0.3857000      -2.471600      0.9094000    
 H   -3.275000      -2.761500     -2.1000000E-02
 H   -3.469500      -1.748700      -1.457700    
 H    2.051900      0.6984000       2.035800    
 H    1.859600       2.144600       1.045600    
 H    1.065200      -2.090500      -1.751900    
 H    1.483300      -3.223300     -0.4757000    
 H    1.068500      0.3995000      -2.179500    
 H    1.275600       1.974200      -1.415100    
 H   -4.990800      -1.629900       1.182500    
 H   -5.601700      -1.345400     -0.4872000    
 H    4.239200       1.659900       1.333800    
 H   -3.760000      0.4175000      -2.133400    
 H   -3.652500       2.075600      -1.571200    
 H   -2.183600       1.196300      -1.995900    
 H    3.581100      -2.466900      0.2926000    
 H    3.620800       2.655900     -0.8423000    
 H    4.873700       1.442000      -1.126700    


%chk=000126221-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126221

0 1
O 3.057314 0.919677 -1.752244
O -5.340987 1.168370 0.921388
O 5.397405 -0.659567 1.085829
C -0.145137 0.249707 0.401111
C -0.985004 -0.824952 -0.371580
C -2.432706 -0.770100 0.157186
C 1.382397 0.265462 0.005253
C -3.090328 0.630085 -0.017496
C -0.806565 1.662689 0.359702
C -2.294930 1.663448 0.804378
C -0.363004 -2.224621 -0.182176
C -3.506009 -1.764163 -0.363634
C 1.956467 -1.162919 -0.044928
C 2.194221 1.100992 1.039846
C 1.102654 -2.250101 -0.666036
C 1.633355 0.929456 -1.393661
C -4.533969 0.339516 0.438259
C -4.827337 -1.159200 0.193569
C 3.693927 1.053517 0.677778
C -3.226301 1.081931 -1.507820
C 3.238973 -1.435192 0.357891
C 3.880227 1.624937 -0.755763
C 4.201784 -0.391091 0.755574
H -0.165631 -0.077421 1.467780
H -0.982490 -0.592857 -1.458326
H -2.364450 -0.938338 1.258564
H -0.742325 2.084634 -0.661132
H -0.246907 2.354901 1.015457
H -2.365173 1.406529 1.880487
H -2.725555 2.675537 0.689297
H -0.947053 -2.981035 -0.739850
H -0.409038 -2.503380 0.890731
H -3.340076 -2.795048 -0.006946
H -3.516656 -1.796086 -1.469267
H 2.026765 0.702116 2.058455
H 1.851366 2.153290 1.034516
H 1.106225 -2.101572 -1.768532
H 1.563938 -3.238286 -0.486773
H 1.132831 0.385859 -2.212104
H 1.267293 1.978287 -1.374368
H -5.104226 -1.612343 1.165342
H -5.704206 -1.278958 -0.467667
H 4.301653 1.666600 1.369025
H -3.805634 0.363379 -2.114802
H -3.750367 2.053600 -1.546129
H -2.241264 1.203770 -1.988538
H 3.630608 -2.459932 0.322541
H 3.611196 2.705535 -0.747479
H 4.918328 1.507235 -1.104907


