COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.265   2.178  -2.009  1.00  0.00           C  
HETATM    2  O   UNL     1       0.191   1.849  -1.089  1.00  0.00           O  
HETATM    3  C   UNL     1      -0.967   1.421  -1.629  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.076   1.325  -2.836  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.100   1.069  -0.758  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.043   2.046  -0.400  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.914   3.316  -0.857  1.00  0.00           O  
HETATM    8  C   UNL     1      -4.105   1.707   0.420  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.236   0.407   0.886  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.279   0.079   1.690  1.00  0.00           O  
HETATM   11  C   UNL     1      -3.302  -0.563   0.532  1.00  0.00           C  
HETATM   12 CL   UNL     1      -3.476  -2.187   1.121  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -2.244  -0.240  -0.287  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.239  -1.295  -0.672  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.108  -1.322   0.358  1.00  0.00           C  
HETATM   16  C   UNL     1       0.897  -2.377  -0.027  1.00  0.00           C  
HETATM   17  N   UNL     1       0.866  -3.628   0.343  1.00  0.00           N  
HETATM   18  C   UNL     1       1.916  -4.272  -0.188  1.00  0.00           C  
HETATM   19  C   UNL     1       2.625  -3.386  -0.914  1.00  0.00           C  
HETATM   20  N   UNL     1       1.976  -2.185  -0.817  1.00  0.00           N  
HETATM   21  C   UNL     1       2.378  -0.926  -1.449  1.00  0.00           C  
HETATM   22  C   UNL     1       3.194  -0.114  -0.477  1.00  0.00           C  
HETATM   23  O   UNL     1       2.709   0.784   0.398  1.00  0.00           O  
HETATM   24  C   UNL     1       3.722   1.314   1.103  1.00  0.00           C  
HETATM   25 CL   UNL     1       3.574   2.516   2.347  1.00  0.00          Cl  
HETATM   26  C   UNL     1       4.872   0.754   0.681  1.00  0.00           C  
HETATM   27  C   UNL     1       4.530  -0.170  -0.333  1.00  0.00           C  
HETATM   28  H   UNL     1       2.138   2.508  -1.445  1.00  0.00           H  
HETATM   29  H   UNL     1       1.524   1.296  -2.595  1.00  0.00           H  
HETATM   30  H   UNL     1       0.941   2.976  -2.676  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.394   3.891  -0.279  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.833   2.455   0.697  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.064  -0.222   1.213  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.727  -2.269  -0.701  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.829  -1.065  -1.655  1.00  0.00           H  
HETATM   36  H   UNL     1       0.381  -0.348   0.387  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.517  -1.552   1.342  1.00  0.00           H  
HETATM   38  H   UNL     1       2.152  -5.318  -0.056  1.00  0.00           H  
HETATM   39  H   UNL     1       3.529  -3.587  -1.470  1.00  0.00           H  
HETATM   40  H   UNL     1       2.975  -1.139  -2.335  1.00  0.00           H  
HETATM   41  H   UNL     1       1.489  -0.364  -1.736  1.00  0.00           H  
HETATM   42  H   UNL     1       5.865   0.967   1.050  1.00  0.00           H  
HETATM   43  H   UNL     1       5.211  -0.798  -0.887  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    3    1                                                 
CONECT    3    4    4    5    2                                       
CONECT    4    3    3                                                 
CONECT    5    6    3   13   13                                       
CONECT    6    7    8    8    5                                       
CONECT    7    6   31                                                 
CONECT    8    6    6    9   32                                       
CONECT    9    8   10   11   11                                       
CONECT   10    9   33                                                 
CONECT   11    9    9   13   12                                       
CONECT   12   11                                                      
CONECT   13    5    5   11   14                                       
CONECT   14   13   15   34   35                                       
CONECT   15   14   16   36   37                                       
CONECT   16   15   17   17   20                                       
CONECT   17   16   16   18                                            
CONECT   18   17   19   19   38                                       
CONECT   19   18   18   20   39                                       
CONECT   20   16   19   21                                            
CONECT   21   20   22   40   41                                       
CONECT   22   21   23   27   27                                       
CONECT   23   22   24                                                 
CONECT   24   23   26   26   25                                       
CONECT   25   24                                                      
CONECT   26   27   24   24   42                                       
CONECT   27   22   22   26   43                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
