COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.503  -0.979  -1.828  1.00  0.00           C  
HETATM    2  C   UNL     1       3.019  -0.666  -1.630  1.00  0.00           C  
HETATM    3  C   UNL     1       1.039  -1.021  -0.147  1.00  0.00           C  
HETATM    4  O   UNL     1       0.309  -3.162   0.735  1.00  0.00           O  
HETATM    5  C   UNL     1      -0.799  -1.163   1.470  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.102  -1.686   0.942  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.154  -0.107  -1.011  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.168   0.700  -0.825  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.425   0.191  -0.168  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.067   1.114  -0.641  1.00  0.00           C  
HETATM   11  C   UNL     1       1.682   1.182   1.082  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.282   2.558  -0.427  1.00  0.00           C  
HETATM   13  C   UNL     1       2.524  -1.334  -0.345  1.00  0.00           C  
HETATM   14  C   UNL     1       0.511  -1.789   1.074  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.801  -0.221   2.226  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.229  -1.554  -0.575  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.171  -2.285  -1.199  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.890   0.387  -1.667  1.00  0.00           C  
HETATM   19  C   UNL     1       0.861   0.466   0.087  1.00  0.00           C  
HETATM   20  O   UNL     1       2.799   1.560   0.789  1.00  0.00           O  
HETATM   21  O   UNL     1       1.193   1.417   2.315  1.00  0.00           O  
HETATM   22  O   UNL     1      -1.121   3.241  -1.230  1.00  0.00           O  
HETATM   23  O   UNL     1       0.299   3.132   0.473  1.00  0.00           O  
HETATM   24  H   UNL     1       5.071  -0.600  -0.978  1.00  0.00           H  
HETATM   25  H   UNL     1       4.640  -2.058  -1.904  1.00  0.00           H  
HETATM   26  H   UNL     1       4.856  -0.503  -2.743  1.00  0.00           H  
HETATM   27  H   UNL     1       2.882   0.413  -1.554  1.00  0.00           H  
HETATM   28  H   UNL     1       2.451  -1.045  -2.479  1.00  0.00           H  
HETATM   29  H   UNL     1       0.482  -1.321  -1.035  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.052  -3.696   1.455  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.192  -2.739   1.210  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.917  -1.135   1.411  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.104   1.731  -1.142  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.153   1.000  -0.099  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.842  -0.623  -0.762  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.191  -0.173   0.833  1.00  0.00           H  
HETATM   37  H   UNL     1       2.661  -2.413  -0.421  1.00  0.00           H  
HETATM   38  H   UNL     1       3.092  -0.955   0.504  1.00  0.00           H  
HETATM   39  H   UNL     1       1.222  -1.711   1.896  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.185  -1.972  -0.889  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.152  -3.224  -0.967  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.325  -0.459  -2.058  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.141   1.066  -2.482  1.00  0.00           H  
HETATM   44  H   UNL     1       1.768   1.889   2.933  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.229   4.185  -1.051  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    1   13   27   28                                       
CONECT    3   14   19   13   29                                       
CONECT    4   14   30                                                 
CONECT    5    6   15   15   14                                       
CONECT    6   16    5   31   32                                       
CONECT    7    8    8   16   18                                       
CONECT    8    9    7    7   33                                       
CONECT    9    8   34   35   36                                       
CONECT   10   18   12   19   19                                       
CONECT   11   19   20   20   21                                       
CONECT   12   23   23   10   22                                       
CONECT   13    3    2   37   38                                       
CONECT   14    5    4    3   39                                       
CONECT   15    5    5                                                 
CONECT   16   17    7    6   40                                       
CONECT   17   16   41                                                 
CONECT   18    7   10   42   43                                       
CONECT   19   10   10    3   11                                       
CONECT   20   11   11                                                 
CONECT   21   11   44                                                 
CONECT   22   12   45                                                 
CONECT   23   12   12                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
