%chk=000086089.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086089

0 1
 O   -3.758700      0.5069000       1.161300    
 O  -0.3273000       1.425300      -1.319000    
 C  -0.4060000      0.1947000     -0.6054000    
 C   -1.847700     -3.9299998E-02 -0.2731000    
 C   0.4482000      0.2716000      0.6649000    
 C   -2.504300      0.9650000      0.6401000    
 C   -3.991500      -1.279000     -0.4410000    
 C   -2.539700      -1.085000     -0.7551000    
 C   -4.606300     -8.6000003E-03  0.1361000    
 C    1.916400      4.6700001E-02  0.3863000    
 C    2.425600      -1.240600      0.4330000    
 C    2.724100       1.132200      8.9299999E-02
 C    3.780600      -1.448300      0.1756000    
 C    4.079100      0.9243000     -0.1681000    
 C    4.607400     -0.3660000     -0.1249000    
 H  -3.4400001E-02 -0.5900000      -1.274900    
 H   0.1237000     -0.4822000       1.395500    
 H   0.3428000       1.244800       1.162600    
 H   -1.884700       1.177200       1.514700    
 H   -2.672500       1.910800      0.1124000    
 H   -4.538100      -1.574500      -1.342700    
 H   -4.074300      -2.097600      0.2834000    
 H   -2.060300      -1.819600      -1.395000    
 H   -4.759800      0.7561000     -0.6354000    
 H   -5.581900     -0.2322000      0.5794000    
 H  -0.4530000       2.159000     -0.6937000    
 H    1.789200      -2.090100      0.6634000    
 H    2.322100       2.140500      5.2200001E-02
 H    4.191900      -2.453000      0.2084000    
 H    4.723000       1.767000     -0.4026000    
 H    5.662400     -0.5278000     -0.3257000    


%chk=000086089-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086089

0 1
O -3.850928 1.037878 0.926890
O -0.152996 1.203556 -1.206452
C -0.449403 -0.073858 -0.528097
C -1.935845 -0.072097 -0.225555
C 0.419596 -0.233025 0.767356
C -2.523389 1.218715 0.323425
C -4.195809 -1.192619 -0.102471
C -2.710382 -1.172688 -0.415258
C -4.729168 0.245979 0.050005
C 1.906537 -0.146338 0.465562
C 2.640237 -1.299307 0.078650
C 2.581956 1.103652 0.504953
C 4.008536 -1.208098 -0.259661
C 3.952508 1.198025 0.167313
C 4.669214 0.042675 -0.219178
H -0.209865 -0.924399 -1.203166
H 0.165292 -1.209094 1.220026
H 0.126914 0.554705 1.485563
H -1.896339 1.634554 1.131331
H -2.566452 1.976624 -0.487673
H -4.749822 -1.711901 -0.910144
H -4.379581 -1.766032 0.828798
H -2.261248 -2.092432 -0.816620
H -4.800116 0.731642 -0.948094
H -5.718930 0.270401 0.534831
H 0.831105 1.274215 -1.323008
H 2.136894 -2.273973 0.052230
H 2.036872 1.998260 0.829947
H 4.560587 -2.109236 -0.549905
H 4.458860 2.168990 0.209689
H 5.731165 0.113525 -0.479288


