COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.036   2.380  -1.056  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.044   2.236   0.148  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.199   3.434   1.049  1.00  0.00           C  
HETATM    4  N   UNL     1       0.082   1.004   0.681  1.00  0.00           N  
HETATM    5  C   UNL     1       0.117  -0.171  -0.193  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.117  -1.038   0.068  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.109  -1.481   1.427  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.381  -0.217  -0.193  1.00  0.00           C  
HETATM    9  C   UNL     1       1.381  -0.983   0.096  1.00  0.00           C  
HETATM   10  O   UNL     1       1.416  -2.130  -0.756  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.592  -1.103  -0.056  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.458  -2.270   0.222  1.00  0.00           O  
HETATM   13  C   UNL     1      -4.956  -0.538  -0.264  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.091   0.635  -0.543  1.00  0.00           O  
HETATM   15  O   UNL     1      -6.038  -1.329  -0.141  1.00  0.00           O  
HETATM   16  C   UNL     1       2.615  -0.117  -0.164  1.00  0.00           C  
HETATM   17  O   UNL     1       2.561   0.400  -1.496  1.00  0.00           O  
HETATM   18  C   UNL     1       3.878  -0.964   0.004  1.00  0.00           C  
HETATM   19  O   UNL     1       3.931  -1.480   1.335  1.00  0.00           O  
HETATM   20  C   UNL     1       5.111  -0.097  -0.257  1.00  0.00           C  
HETATM   21  O   UNL     1       6.284  -0.913  -0.215  1.00  0.00           O  
HETATM   22  O   UNL     1      -0.319   4.616   0.254  1.00  0.00           O  
HETATM   23  H   UNL     1      -1.094   3.316   1.661  1.00  0.00           H  
HETATM   24  H   UNL     1       0.674   3.519   1.696  1.00  0.00           H  
HETATM   25  H   UNL     1       0.148   0.896   1.643  1.00  0.00           H  
HETATM   26  H   UNL     1       0.122   0.150  -1.234  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.101  -1.902  -0.596  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.048  -0.765   2.074  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.442   0.597   0.530  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.345   0.195  -1.202  1.00  0.00           H  
HETATM   31  H   UNL     1       1.376  -1.305   1.138  1.00  0.00           H  
HETATM   32  H   UNL     1       1.422  -1.919  -1.699  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.901  -0.918  -0.285  1.00  0.00           H  
HETATM   34  H   UNL     1       2.635   0.710   0.545  1.00  0.00           H  
HETATM   35  H   UNL     1       2.541  -0.282  -2.181  1.00  0.00           H  
HETATM   36  H   UNL     1       3.858  -1.791  -0.706  1.00  0.00           H  
HETATM   37  H   UNL     1       3.951  -0.799   2.021  1.00  0.00           H  
HETATM   38  H   UNL     1       5.028   0.368  -1.240  1.00  0.00           H  
HETATM   39  H   UNL     1       5.180   0.677   0.507  1.00  0.00           H  
HETATM   40  H   UNL     1       7.106  -0.429  -0.372  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.423   5.427   0.769  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    4                                       
CONECT    3   22    2   23   24                                       
CONECT    4    2    5   25                                            
CONECT    5    9    4    6   26                                       
CONECT    6    5    8    7   27                                       
CONECT    7    6   28                                                 
CONECT    8    6   11   29   30                                       
CONECT    9   16   10    5   31                                       
CONECT   10    9   32                                                 
CONECT   11    8   13   12   12                                       
CONECT   12   11   11                                                 
CONECT   13   14   14   11   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   33                                                 
CONECT   16   17   18    9   34                                       
CONECT   17   16   35                                                 
CONECT   18   20   16   19   36                                       
CONECT   19   18   37                                                 
CONECT   20   21   18   38   39                                       
CONECT   21   20   40                                                 
CONECT   22    3   41                                                 
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
