COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.016   3.877   0.034  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.049   2.811   0.072  1.00  0.00           C  
HETATM    3  C   UNL     1       0.116   1.500   0.440  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.245   0.942   0.287  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.979   1.944  -0.126  1.00  0.00           N  
HETATM    6  O   UNL     1      -1.339   2.960  -0.240  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.681  -0.452   0.540  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.306  -1.100   1.716  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.715  -2.398   1.946  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.497  -3.056   1.014  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.874  -2.419  -0.154  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.474  -1.118  -0.394  1.00  0.00           C  
HETATM   13 CL   UNL     1      -2.947  -0.319  -1.861  1.00  0.00          Cl  
HETATM   14  C   UNL     1       1.344   0.817   0.879  1.00  0.00           C  
HETATM   15  O   UNL     1       1.685   0.868   2.045  1.00  0.00           O  
HETATM   16  N   UNL     1       2.091   0.135  -0.012  1.00  0.00           N  
HETATM   17  C   UNL     1       3.313  -0.545   0.424  1.00  0.00           C  
HETATM   18  C   UNL     1       3.957  -1.228  -0.755  1.00  0.00           C  
HETATM   19  O   UNL     1       3.447  -1.154  -1.848  1.00  0.00           O  
HETATM   20  O   UNL     1       5.096  -1.918  -0.592  1.00  0.00           O  
HETATM   21  H   UNL     1       1.484   3.887  -0.951  1.00  0.00           H  
HETATM   22  H   UNL     1       0.564   4.849   0.231  1.00  0.00           H  
HETATM   23  H   UNL     1       1.769   3.666   0.792  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.695  -0.588   2.444  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.424  -2.901   2.857  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.812  -4.073   1.197  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.484  -2.938  -0.879  1.00  0.00           H  
HETATM   28  H   UNL     1       1.819   0.094  -0.942  1.00  0.00           H  
HETATM   29  H   UNL     1       4.005   0.185   0.843  1.00  0.00           H  
HETATM   30  H   UNL     1       3.065  -1.288   1.183  1.00  0.00           H  
HETATM   31  H   UNL     1       5.472  -2.338  -1.378  1.00  0.00           H  
CONECT    1    2   21   22   23                                       
CONECT    2    3    3    6    1                                       
CONECT    3    4   14    2    2                                       
CONECT    4    7    5    5    3                                       
CONECT    5    4    4    6                                            
CONECT    6    5    2                                                 
CONECT    7   12   12    8    4                                       
CONECT    8    9    9    7   24                                       
CONECT    9   10    8    8   25                                       
CONECT   10   11   11    9   26                                       
CONECT   11   10   10   12   27                                       
CONECT   12   11   13    7    7                                       
CONECT   13   12                                                      
CONECT   14   16    3   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   17   14   28                                            
CONECT   17   18   16   29   30                                       
CONECT   18   19   19   20   17                                       
CONECT   19   18   18                                                 
CONECT   20   18   31                                                 
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   17                                                      
CONECT   31   20                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
