COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.203  -0.488  -0.067  1.00  0.00           C  
HETATM    2  C   UNL     1       2.403   0.358   0.270  1.00  0.00           C  
HETATM    3  C   UNL     1       3.680  -0.389  -0.122  1.00  0.00           C  
HETATM    4  C   UNL     1       4.899   0.469   0.220  1.00  0.00           C  
HETATM    5  C   UNL     1       6.175  -0.278  -0.171  1.00  0.00           C  
HETATM    6  C   UNL     1       7.394   0.580   0.171  1.00  0.00           C  
HETATM    7  C   UNL     1       8.671  -0.167  -0.221  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.818   1.698  -0.341  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.036   0.814  -0.622  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.945  -0.453   0.234  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.626  -1.168  -0.071  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.462  -0.208   0.188  1.00  0.00           C  
HETATM   13  O   UNL     1      -6.230   1.528  -0.293  1.00  0.00           O  
HETATM   14  O   UNL     1      -6.040  -1.318  -0.075  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.497  -2.313   0.774  1.00  0.00           O  
HETATM   16  O   UNL     1      -2.624   0.963  -0.616  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.143  -0.895  -0.171  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.034  -0.029   0.185  1.00  0.00           O  
HETATM   19  C   UNL     1       9.890   0.692   0.122  1.00  0.00           C  
HETATM   20  O   UNL     1       1.352  -1.577  -0.569  1.00  0.00           O  
HETATM   21  H   UNL     1       2.351   1.299  -0.278  1.00  0.00           H  
HETATM   22  H   UNL     1       2.416   0.561   1.340  1.00  0.00           H  
HETATM   23  H   UNL     1       3.733  -1.330   0.426  1.00  0.00           H  
HETATM   24  H   UNL     1       3.668  -0.593  -1.193  1.00  0.00           H  
HETATM   25  H   UNL     1       4.846   1.410  -0.328  1.00  0.00           H  
HETATM   26  H   UNL     1       4.911   0.673   1.291  1.00  0.00           H  
HETATM   27  H   UNL     1       6.228  -1.219   0.377  1.00  0.00           H  
HETATM   28  H   UNL     1       8.724  -1.108   0.327  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.856   2.582  -0.979  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.053   0.541  -1.677  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.981  -0.184   1.289  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.614  -1.482  -1.115  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.451   0.073   1.241  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.350   2.346  -0.795  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.909  -0.926   0.087  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.205  -2.964   0.666  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.062  -1.834   0.376  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.118  -1.096  -1.242  1.00  0.00           H  
HETATM   39  H   UNL     1      10.799   0.159  -0.157  1.00  0.00           H  
HETATM   40  H   UNL     1       9.837   1.632  -0.426  1.00  0.00           H  
HETATM   41  H   UNL     1       9.902   0.895   1.192  1.00  0.00           H  
HETATM   42  O   UNL     1      -3.826   2.099   1.030  1.00  0.00           O  
HETATM   43  H   UNL     1      -3.081   2.662   1.280  1.00  0.00           H  
HETATM   44  H   UNL     1       6.163  -0.482  -1.242  1.00  0.00           H  
HETATM   45  H   UNL     1       7.342   1.521  -0.377  1.00  0.00           H  
HETATM   46  H   UNL     1       7.407   0.784   1.242  1.00  0.00           H  
HETATM   47  H   UNL     1       8.659  -0.370  -1.291  1.00  0.00           H  
CONECT    1   20   20    2   18                                       
CONECT    2    1    3   21   22                                       
CONECT    3    2    4   23   24                                       
CONECT    4    3    5   25   26                                       
CONECT    5    4    6   27   44                                       
CONECT    6    5    7   45   46                                       
CONECT    7    6   19   28   47                                       
CONECT    8   16    9   29   42                                       
CONECT    9    8   10   13   30                                       
CONECT   10    9   14   11   31                                       
CONECT   11   10   15   12   32                                       
CONECT   12   11   16   17   33                                       
CONECT   13    9   34                                                 
CONECT   14   10   35                                                 
CONECT   15   11   36                                                 
CONECT   16    8   12                                                 
CONECT   17   12   18   37   38                                       
CONECT   18    1   17                                                 
CONECT   19    7   39   40   41                                       
CONECT   20    1    1                                                 
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42    8   43                                                 
CONECT   43   42                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
