COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.933  -1.278  -0.052  1.00  0.00           C  
HETATM    2  C   UNL     1       3.715  -0.396  -0.143  1.00  0.00           C  
HETATM    3  O   UNL     1       3.837   0.811  -0.115  1.00  0.00           O  
HETATM    4  N   UNL     1       2.490  -0.947  -0.256  1.00  0.00           N  
HETATM    5  C   UNL     1       1.352  -0.132  -0.236  1.00  0.00           C  
HETATM    6  C   UNL     1       0.185  -0.584   0.366  1.00  0.00           C  
HETATM    7  C   UNL     1       1.390   1.130  -0.813  1.00  0.00           C  
HETATM    8  C   UNL     1       0.265   1.931  -0.792  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.898   1.478  -0.196  1.00  0.00           C  
HETATM   10 CL   UNL     1      -2.310   2.488  -0.171  1.00  0.00          Cl  
HETATM   11  C   UNL     1      -0.937   0.222   0.384  1.00  0.00           C  
HETATM   12  S   UNL     1      -2.419  -0.350   1.148  1.00  0.00           S  
HETATM   13  O   UNL     1      -2.158  -1.676   1.586  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.847   0.687   2.020  1.00  0.00           O  
HETATM   15  N   UNL     1      -3.568  -0.467  -0.039  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.379  -1.403  -1.151  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.155  -2.692  -0.870  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.896  -0.769  -2.444  1.00  0.00           C  
HETATM   19  H   UNL     1       4.852  -1.921   0.825  1.00  0.00           H  
HETATM   20  H   UNL     1       5.003  -1.894  -0.949  1.00  0.00           H  
HETATM   21  H   UNL     1       2.398  -1.908  -0.351  1.00  0.00           H  
HETATM   22  H   UNL     1       0.154  -1.564   0.819  1.00  0.00           H  
HETATM   23  H   UNL     1       2.298   1.485  -1.278  1.00  0.00           H  
HETATM   24  H   UNL     1       0.294   2.913  -1.241  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.365   0.083   0.002  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.319  -1.632  -1.257  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.215  -2.462  -0.764  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.015  -3.388  -1.697  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.786  -3.143   0.051  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.344   0.150  -2.644  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.756  -1.464  -3.271  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.956  -0.539  -2.338  1.00  0.00           H  
HETATM   33 CL   UNL     1       6.410  -0.252   0.089  1.00  0.00          Cl  
CONECT    1    2   19   20   33                                       
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   21                                            
CONECT    5    4    7    7    6                                       
CONECT    6    5   11   11   22                                       
CONECT    7    5    5    8   23                                       
CONECT    8    7    9    9   24                                       
CONECT    9    8    8   11   10                                       
CONECT   10    9                                                      
CONECT   11    6    6    9   12                                       
CONECT   12   11   13   13   15                                       
CONECT   12   14   14                                                 
CONECT   13   12   12                                                 
CONECT   14   12   12                                                 
CONECT   15   16   12   25                                            
CONECT   16   18   17   15   26                                       
CONECT   17   16   27   28   29                                       
CONECT   18   16   30   31   32                                       
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    4                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25   15                                                      
CONECT   26   16                                                      
CONECT   27   17                                                      
CONECT   28   17                                                      
CONECT   29   17                                                      
CONECT   30   18                                                      
CONECT   31   18                                                      
CONECT   32   18                                                      
CONECT   33    1                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
