%chk=000098059.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098059

0 1
 O    2.707100      0.8469000       2.028000    
 O   -3.636800      -2.127100     -8.9000002E-02
 O    1.189800      -1.998000      0.9441000    
 C    2.502900     -0.3286000     -5.2499998E-02
 C   -2.519200     -9.2000002E-03  0.1128000    
 C    1.208400     -0.9132000      0.3733000    
 C   -1.241600     -0.6520000      0.3890000    
 C    3.187300      0.5216000      0.7945000    
 C   -3.669700     -0.7640000     -0.1162000    
 C  -3.2099999E-02 -0.1533000      5.2900001E-02
 C    2.987500     -0.6588000      -1.304100    
 C   -2.580700       1.383900      7.8900002E-02
 C    4.402300       1.062700      0.3745000    
 C   -4.881600     -0.1257000     -0.3794000    
 C    4.202500     -0.1178000      -1.724100    
 C   -3.792800       2.022200     -0.1842000    
 C    4.909900      0.7431000     -0.8849000    
 C   -4.943100       1.267400     -0.4136000    
 H   -1.301000      -1.612800      0.8951000    
 H   8.7600000E-02  0.7877000     -0.4731000    
 H    2.442400      -1.328400      -1.963100    
 H   -1.710800       2.006500      0.2706000    
 H    4.964200       1.734800       1.017500    
 H   -5.786200     -0.7003000     -0.5597000    
 H    4.597900     -0.3665000      -2.704600    
 H   -3.842200       3.107000     -0.2066000    
 H    5.856000       1.164300      -1.212200    
 H   -5.887000       1.764600     -0.6175000    
 H    3.331300       1.453300       2.462200    
 H   -4.528300      -2.471000     -0.2701000    


%chk=000098059-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000098059

0 1
O 1.901305 1.886573 0.437992
O -3.708906 -2.037821 -0.603017
O 1.045379 -2.148800 -0.884476
C 2.544057 -0.330516 -0.416528
C -2.567104 0.011259 -0.023427
C 1.154411 -0.929165 -0.514686
C -1.299245 -0.668246 -0.298163
C 2.900046 0.980300 0.024372
C -3.797805 -0.702173 -0.183356
C -0.045001 -0.117564 -0.199827
C 3.612106 -1.187732 -0.810407
C -2.655374 1.368671 0.403263
C 4.256297 1.393812 0.060235
C -5.046174 -0.087049 0.069761
C 4.958673 -0.787559 -0.779053
C -3.891660 1.989871 0.657960
C 5.283629 0.518031 -0.339054
C -5.093528 1.258022 0.490071
H -1.362708 -1.717269 -0.613354
H 0.120106 0.916258 0.107266
H 3.323364 -2.190721 -1.142163
H -1.729863 1.938542 0.535435
H 4.503813 2.407724 0.403850
H -5.975624 -0.656616 -0.061167
H 5.747465 -1.478811 -1.091874
H -3.925841 3.034149 0.984621
H 6.326133 0.852835 -0.305911
H -6.061655 1.731605 0.685294
H 2.313335 2.739463 0.725258
H -4.605631 -2.447772 -0.680415


