COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       2.295  -2.866   0.082  1.00  0.00          Cl  
HETATM    2  C   UNL     1       3.242  -1.416  -0.043  1.00  0.00           C  
HETATM    3  C   UNL     1       4.612  -1.467   0.147  1.00  0.00           C  
HETATM    4  C   UNL     1       5.366  -0.313   0.048  1.00  0.00           C  
HETATM    5  C   UNL     1       4.751   0.892  -0.242  1.00  0.00           C  
HETATM    6 CL   UNL     1       5.699   2.342  -0.366  1.00  0.00          Cl  
HETATM    7  C   UNL     1       3.382   0.942  -0.433  1.00  0.00           C  
HETATM    8  C   UNL     1       2.628  -0.212  -0.339  1.00  0.00           C  
HETATM    9  C   UNL     1       1.138  -0.159  -0.552  1.00  0.00           C  
HETATM   10  S   UNL     1       0.311   0.156   1.032  1.00  0.00           S  
HETATM   11  C   UNL     1      -1.394   0.185   0.591  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.874   0.007  -0.639  1.00  0.00           N  
HETATM   13  N   UNL     1      -2.393   0.379   1.427  1.00  0.00           N  
HETATM   14  N   UNL     1      -3.573   0.325   0.674  1.00  0.00           N  
HETATM   15  C   UNL     1      -3.200   0.089  -0.619  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.124  -0.017  -1.580  1.00  0.00           N  
HETATM   17  C   UNL     1      -5.406   0.105  -1.305  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.424  -0.020  -2.409  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.827   0.349   0.001  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.891   0.454   0.994  1.00  0.00           C  
HETATM   21  O   UNL     1      -5.268   0.685   2.272  1.00  0.00           O  
HETATM   22  H   UNL     1       5.091  -2.408   0.373  1.00  0.00           H  
HETATM   23  H   UNL     1       6.435  -0.352   0.196  1.00  0.00           H  
HETATM   24  H   UNL     1       2.903   1.883  -0.659  1.00  0.00           H  
HETATM   25  H   UNL     1       0.899   0.642  -1.251  1.00  0.00           H  
HETATM   26  H   UNL     1       0.794  -1.110  -0.958  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.225   0.760   2.392  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.915  -0.209  -3.354  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.099  -0.847  -2.189  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.995   0.905  -2.484  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.878   0.450   0.227  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    8    8                                       
CONECT    3    2    4    4   22                                       
CONECT    4    3    3    5   23                                       
CONECT    5    4    6    7    7                                       
CONECT    6    5                                                      
CONECT    7    5    5    8   24                                       
CONECT    8    2    2    7    9                                       
CONECT    9    8   10   25   26                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   13   13                                       
CONECT   12   11   15   15                                            
CONECT   13   11   11   14                                            
CONECT   14   13   15   20                                            
CONECT   15   12   12   14   16                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   19                                       
CONECT   18   17   28   29   30                                       
CONECT   19   17   20   20   31                                       
CONECT   20   14   19   19   21                                       
CONECT   21   20   27                                                 
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    7                                                      
CONECT   25    9                                                      
CONECT   26    9                                                      
CONECT   27   21                                                      
CONECT   28   18                                                      
CONECT   29   18                                                      
CONECT   30   18                                                      
CONECT   31   19                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
