COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.820   1.161  -0.521  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.051   1.188   0.111  1.00  0.00           C  
HETATM    3 CL   UNL     1      -6.836   2.705   0.419  1.00  0.00          Cl  
HETATM    4  C   UNL     1      -6.656   0.005   0.495  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.030  -1.204   0.249  1.00  0.00           C  
HETATM    6 CL   UNL     1      -6.789  -2.689   0.731  1.00  0.00          Cl  
HETATM    7  C   UNL     1      -4.799  -1.229  -0.382  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.195  -0.047  -0.767  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.856  -0.075  -1.459  1.00  0.00           C  
HETATM   10  N   UNL     1      -1.785  -0.005  -0.457  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.463  -0.030  -1.097  1.00  0.00           C  
HETATM   12  C   UNL     1       0.625   0.045  -0.024  1.00  0.00           C  
HETATM   13  C   UNL     1       2.002   0.018  -0.690  1.00  0.00           C  
HETATM   14  N   UNL     1       3.043   0.090   0.337  1.00  0.00           N  
HETATM   15  C   UNL     1       4.343   0.081  -0.019  1.00  0.00           C  
HETATM   16  O   UNL     1       4.652   0.014  -1.193  1.00  0.00           O  
HETATM   17  N   UNL     1       5.302   0.147   0.926  1.00  0.00           N  
HETATM   18  C   UNL     1       6.657   0.024   0.565  1.00  0.00           C  
HETATM   19  C   UNL     1       7.068  -0.647  -0.578  1.00  0.00           C  
HETATM   20  C   UNL     1       8.388  -0.669  -0.772  1.00  0.00           C  
HETATM   21  S   UNL     1       9.193   0.191   0.534  1.00  0.00           S  
HETATM   22  C   UNL     1       7.648   0.550   1.293  1.00  0.00           C  
HETATM   23  H   UNL     1      -4.349   2.085  -0.825  1.00  0.00           H  
HETATM   24  H   UNL     1      -7.617   0.025   0.988  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.310  -2.172  -0.575  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.761  -1.000  -2.028  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.779   0.777  -2.135  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.888   0.812   0.127  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.351  -0.954  -1.664  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.368   0.822  -1.770  1.00  0.00           H  
HETATM   31  H   UNL     1       0.513   0.969   0.543  1.00  0.00           H  
HETATM   32  H   UNL     1       0.531  -0.808   0.649  1.00  0.00           H  
HETATM   33  H   UNL     1       2.114  -0.906  -1.257  1.00  0.00           H  
HETATM   34  H   UNL     1       2.096   0.871  -1.363  1.00  0.00           H  
HETATM   35  H   UNL     1       2.798   0.144   1.274  1.00  0.00           H  
HETATM   36  H   UNL     1       5.058   0.279   1.856  1.00  0.00           H  
HETATM   37  H   UNL     1       6.373  -1.116  -1.259  1.00  0.00           H  
HETATM   38  H   UNL     1       8.886  -1.144  -1.604  1.00  0.00           H  
HETATM   39  H   UNL     1       7.519   1.108   2.209  1.00  0.00           H  
CONECT    1    2    8    8   23                                       
CONECT    2    3    4    4    1                                       
CONECT    3    2                                                      
CONECT    4    2    2    5   24                                       
CONECT    5    4    6    7    7                                       
CONECT    6    5                                                      
CONECT    7    5    5    8   25                                       
CONECT    8    1    1    7    9                                       
CONECT    9    8   10   26   27                                       
CONECT   10    9   11   28                                            
CONECT   11   10   12   29   30                                       
CONECT   12   11   13   31   32                                       
CONECT   13   12   14   33   34                                       
CONECT   14   13   15   35                                            
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   18   36                                            
CONECT   18   17   19   22   22                                       
CONECT   19   18   20   20   37                                       
CONECT   20   19   19   21   38                                       
CONECT   21   22   20                                                 
CONECT   22   18   18   21   39                                       
CONECT   23    1                                                      
CONECT   24    4                                                      
CONECT   25    7                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
