COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.500   5.750   0.223  1.00  0.00           C  
HETATM    2  C   UNL     1       4.768  -1.182  -0.059  1.00  0.00           C  
HETATM    3  C   UNL     1       6.125  -1.764  -0.063  1.00  0.00           C  
HETATM    4  C   UNL     1       3.726  -1.844   0.596  1.00  0.00           C  
HETATM    5  C   UNL     1       2.463  -1.297   0.604  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.641   0.405  -0.074  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.049  -1.012  -0.026  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.306  -1.710  -1.210  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.687  -3.036  -1.157  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.814  -3.674   0.064  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.562  -2.991   1.240  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.276   4.262   0.149  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.175  -1.666   1.203  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.240   3.353   0.091  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.813   2.022   0.027  1.00  0.00           C  
HETATM   16  C   UNL     1       0.557   1.892   0.035  1.00  0.00           C  
HETATM   17  C   UNL     1       0.863   0.505  -0.032  1.00  0.00           C  
HETATM   18  C   UNL     1       2.223  -0.083  -0.042  1.00  0.00           C  
HETATM   19  C   UNL     1       3.263   0.578  -0.697  1.00  0.00           C  
HETATM   20  C   UNL     1       4.527   0.033  -0.706  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.263  -0.167  -0.072  1.00  0.00           N  
HETATM   22  N   UNL     1      -1.333   0.731  -0.046  1.00  0.00           N  
HETATM   23  O   UNL     1       7.032  -1.187  -0.628  1.00  0.00           O  
HETATM   24  O   UNL     1       6.357  -2.936   0.560  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.483   1.278  -0.138  1.00  0.00           O  
HETATM   26  S   UNL     1       1.299   3.486   0.119  1.00  0.00           S  
HETATM   27 CL   UNL     1      -3.146  -0.910  -2.743  1.00  0.00          Cl  
HETATM   28 CL   UNL     1      -2.859  -0.811   2.681  1.00  0.00          Cl  
HETATM   29  H   UNL     1      -0.566   6.056   1.267  1.00  0.00           H  
HETATM   30  H   UNL     1       0.332   6.267  -0.255  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.428   6.004  -0.289  1.00  0.00           H  
HETATM   32  H   UNL     1       3.911  -2.783   1.095  1.00  0.00           H  
HETATM   33  H   UNL     1       1.656  -1.808   1.110  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.886  -3.576  -2.071  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.113  -4.711   0.098  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.665  -3.496   2.189  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.286   3.622   0.094  1.00  0.00           H  
HETATM   38  H   UNL     1       3.077   1.517  -1.196  1.00  0.00           H  
HETATM   39  H   UNL     1       5.332   0.545  -1.212  1.00  0.00           H  
HETATM   40  H   UNL     1       7.261  -3.277   0.531  1.00  0.00           H  
CONECT    1   12   29   30   31                                       
CONECT    2    3   20   20    4                                       
CONECT    3   23   23   24    2                                       
CONECT    4    2    5    5   32                                       
CONECT    5    4    4   18   33                                       
CONECT    6    7   22   25   25                                       
CONECT    7   13   13    8    6                                       
CONECT    8    9    9    7   27                                       
CONECT    9   10    8    8   34                                       
CONECT   10   11   11    9   35                                       
CONECT   11   10   10   13   36                                       
CONECT   12   26   14   14    1                                       
CONECT   13   11   28    7    7                                       
CONECT   14   15   12   12   37                                       
CONECT   15   16   16   22   14                                       
CONECT   16   17   26   15   15                                       
CONECT   17   18   21   21   16                                       
CONECT   18   19   19    5   17                                       
CONECT   19   20   18   18   38                                       
CONECT   20    2    2   19   39                                       
CONECT   21   17   17   22                                            
CONECT   22   21    6   15                                            
CONECT   23    3    3                                                 
CONECT   24    3   40                                                 
CONECT   25    6    6                                                 
CONECT   26   16   12                                                 
CONECT   27    8                                                      
CONECT   28   13                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   14                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   24                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
