COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.968   4.066   5.984  1.00  0.00           N  
HETATM    2  CA  UNL     1      -1.273   2.863   5.600  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.146   1.616   5.874  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.379   0.362   6.018  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.848  -0.172   7.225  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.856   0.247   8.571  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.200  -1.364   6.896  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.338  -1.539   5.537  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.049  -0.500   4.998  1.00  0.00           C  
HETATM   10  C   UNL     1       0.443  -2.163   7.849  1.00  0.00           C  
HETATM   11  C   UNL     1       0.422  -1.728   9.177  1.00  0.00           C  
HETATM   12 CL   UNL     1       1.197  -2.676  10.389  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -0.217  -0.542   9.535  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.843   2.920   4.141  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.507   3.474   3.271  1.00  0.00           O  
HETATM   16  OXT UNL     1       0.340   2.317   3.872  1.00  0.00           O  
HETATM   17  H1  UNL     1      -2.265   4.708   5.269  1.00  0.00           H  
HETATM   18  H2  UNL     1      -1.965   4.343   6.951  1.00  0.00           H  
HETATM   19  HA  UNL     1      -0.357   2.834   6.201  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.747   1.793   6.789  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.908   1.533   5.071  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.349   1.168   8.866  1.00  0.00           H  
HETATM   23  H   UNL     1       0.029  -2.321   5.014  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.257  -0.469   3.937  1.00  0.00           H  
HETATM   25  H   UNL     1       0.938  -3.084   7.558  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.228  -0.211  10.571  1.00  0.00           H  
HETATM   27  HXT UNL     1       0.619   2.358   2.934  1.00  0.00           H  
CONECT    1    2   17   18                                            
CONECT    2    1    3   14   19                                       
CONECT    3    2    4   20   21                                       
CONECT    4    3    5    9    9                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5   13   22                                       
CONECT    7    5    8   10   10                                       
CONECT    8    7    9   23                                            
CONECT    9    4    4    8   24                                       
CONECT   10    7    7   11   25                                       
CONECT   11   10   12   13   13                                       
CONECT   12   11                                                      
CONECT   13    6   11   11   26                                       
CONECT   14    2   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   27                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21    3                                                      
CONECT   22    6                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   13                                                      
CONECT   27   16                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
