%chk=000005465.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005465

0 1
 O    2.052200     -0.4130000      0.8233000    
 O   -2.804100       1.798300     -0.5701000    
 O    2.470500     -0.8293000      -1.442000    
 C   -2.707900      -1.003800     -2.2200000E-02
 C   -1.506800     -0.1197000      5.0200000E-02
 C   -1.607300       1.243400     -0.2284000    
 C  -0.2748000     -0.6708000      0.4022000    
 C   -3.052100      -1.639100       1.337400    
 C   -2.565200      -2.101800      -1.092400    
 C   0.7567000       1.504300      0.1970000    
 C   0.8569000      0.1412000      0.4756000    
 C  -0.4755000       2.055500     -0.1549000    
 C    1.957900       2.388100      0.2706000    
 C    2.804000     -0.8821000     -0.2656000    
 C    4.095600      -1.470900      0.2192000    
 H   -3.602600     -0.4362000     -0.2961000    
 H  -0.1794000      -1.730800      0.6239000    
 H   -2.270400      -2.325600       1.680000    
 H   -3.986200      -2.207800       1.270800    
 H   -3.182300     -0.8684000       2.105300    
 H   -2.349000      -1.662800      -2.072700    
 H   -3.493800      -2.676500      -1.179300    
 H   -1.760700      -2.806000     -0.8545000    
 H  -0.5631000       3.116800     -0.3747000    
 H    1.683400       3.448100      0.2404000    
 H    2.502400       2.225900       1.206800    
 H    2.626700       2.190000     -0.5730000    
 H   -3.248300       1.216100      -1.208500    
 H    4.676600     -0.7061000      0.7404000    
 H    4.675600      -1.827600     -0.6367000    
 H    3.890500      -2.316600      0.8800000    


%chk=000005465-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005465

0 1
O 2.061943 -0.576774 0.677328
O -2.829056 1.953187 -0.513271
O 3.005210 -0.328396 -1.458976
C -2.837407 -1.048913 -0.063804
C -1.590460 -0.158764 -0.025704
C -1.638949 1.248253 -0.239484
C -0.319819 -0.718601 0.250619
C -3.178294 -1.600710 1.347545
C -2.697980 -2.198172 -1.096572
C 0.794737 1.480563 0.092376
C 0.833424 0.078599 0.301276
C -0.470896 2.042459 -0.178351
C 2.042104 2.337359 0.152723
C 3.090831 -0.731766 -0.283787
C 4.263670 -1.445586 0.351753
H -3.715272 -0.445703 -0.389279
H -0.216478 -1.793497 0.432594
H -2.357857 -2.239017 1.723498
H -4.098992 -2.212465 1.317178
H -3.325081 -0.781650 2.074076
H -2.481329 -1.805309 -2.105640
H -3.628142 -2.794168 -1.143433
H -1.875170 -2.881194 -0.817832
H -0.572528 3.118914 -0.347886
H 1.783203 3.407682 0.206315
H 2.661439 2.085578 1.033086
H 2.666046 2.176999 -0.745959
H -3.599307 1.333123 -0.558710
H 4.646208 -0.858956 1.204980
H 5.061059 -1.585643 -0.391814
H 3.942643 -2.424634 0.747155


