%chk=000049017.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049017

0 1
 O   -1.461700      0.1940000      0.6370000    
 O   -4.102300       1.092700       1.072600    
 O   -5.976100      0.7330000     -0.9392000    
 O    4.439300      5.9400000E-02 -0.3257000    
 O    3.278600       2.014400      3.3900000E-02
 C   -3.720900      0.4804000     -0.1616000    
 C   -2.586500     -0.5013000      0.1091000    
 C   -4.943400     -0.2253000     -0.7336000    
 C  -0.2298000     -0.3514000      0.3910000    
 C   0.8821000      0.4772000      0.2849000    
 C    2.136400     -7.8500003E-02  3.3199999E-02
 C  -0.1024000      -1.728900      0.2482000    
 C    2.271400      -1.459400     -0.1109000    
 C    1.152000      -2.284500     -3.4000000E-03
 C    3.303800      0.7817000     -7.9300001E-02
 C    5.659500      0.7966000     -0.4562000    
 H   -3.391000       1.291900     -0.8187000    
 H   -2.342600     -0.9986000     -0.8387000    
 H   -2.903500      -1.248000      0.8473000    
 H   -5.330600     -0.9870000     -4.8799999E-02
 H   -4.716900     -0.6972000      -1.694100    
 H   0.7593000       1.551200      0.3995000    
 H  -0.9422000      -2.408900      0.3522000    
 H    3.227700      -1.936500     -0.3060000    
 H    1.258100      -3.360400     -0.1092000    
 H   -4.395800      0.3906000       1.678200    
 H   -6.163500       1.148400     -8.0100000E-02
 H    5.876100       1.334300      0.4716000    
 H    5.592000       1.491100      -1.298800    
 H    6.467600      8.6099997E-02 -0.6488000    


%chk=000049017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000049017

0 1
O -1.502653 0.194093 -0.265326
O -3.845171 1.157927 0.989302
O -6.312175 0.711336 -0.130182
O 4.545375 0.088511 0.009550
O 3.242065 2.017194 -0.067974
C -3.881659 0.370491 -0.257054
C -2.726547 -0.630040 -0.286806
C -5.264797 -0.298893 -0.245195
C -0.260142 -0.461187 -0.203716
C 0.869725 0.384857 -0.161475
C 2.164182 -0.177967 -0.097851
C -0.102451 -1.869554 -0.186571
C 2.336428 -1.588120 -0.077331
C 1.200163 -2.418433 -0.122854
C 3.322196 0.764011 -0.053216
C 5.745484 0.955127 0.057495
H -3.802751 1.050737 -1.130312
H -2.755131 -1.249584 -1.206545
H -2.756114 -1.283297 0.608681
H -5.312929 -1.022630 0.597677
H -5.453397 -0.829594 -1.193533
H 0.748247 1.472039 -0.179298
H -0.968046 -2.537287 -0.222968
H 3.344261 -2.006312 -0.027307
H 1.319510 -3.507051 -0.109059
H -2.964370 1.607309 1.049435
H -6.037953 1.314762 0.610735
H 5.709594 1.609036 0.945075
H 5.800552 1.581665 -0.848675
H 6.593206 0.257952 0.110898


