COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.750  -0.306   0.065  1.00  0.00           C  
HETATM    2  C   UNL     1       3.747  -1.259   0.045  1.00  0.00           C  
HETATM    3  C   UNL     1       5.077  -0.873  -0.005  1.00  0.00           C  
HETATM    4 CL   UNL     1       6.326  -2.078  -0.030  1.00  0.00          Cl  
HETATM    5  C   UNL     1       5.414   0.470  -0.038  1.00  0.00           C  
HETATM    6  C   UNL     1       4.427   1.433  -0.018  1.00  0.00           C  
HETATM    7  C   UNL     1       3.084   1.050   0.033  1.00  0.00           C  
HETATM    8  C   UNL     1       2.022   2.075   0.053  1.00  0.00           C  
HETATM    9  O   UNL     1       0.700   1.832   0.102  1.00  0.00           O  
HETATM   10  C   UNL     1       2.220   3.427   0.032  1.00  0.00           C  
HETATM   11  C   UNL     1       0.959   4.028   0.063  1.00  0.00           C  
HETATM   12  C   UNL     1       0.030   3.004   0.107  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.372   3.158   0.152  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.183   2.065   0.038  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.814   0.742  -0.318  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.662   0.442  -0.572  1.00  0.00           O  
HETATM   17  S   UNL     1      -3.935   1.977   0.309  1.00  0.00           S  
HETATM   18  C   UNL     1      -4.041   0.247  -0.066  1.00  0.00           C  
HETATM   19  S   UNL     1      -5.450  -0.725  -0.054  1.00  0.00           S  
HETATM   20  N   UNL     1      -2.793  -0.146  -0.359  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.517  -1.539  -0.716  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.195  -2.337   0.549  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.911  -3.770   0.181  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.961  -4.119  -0.975  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.603  -4.660   1.138  1.00  0.00           O  
HETATM   26  H   UNL     1       1.714  -0.608   0.100  1.00  0.00           H  
HETATM   27  H   UNL     1       3.491  -2.307   0.070  1.00  0.00           H  
HETATM   28  H   UNL     1       6.452   0.764  -0.078  1.00  0.00           H  
HETATM   29  H   UNL     1       4.691   2.479  -0.043  1.00  0.00           H  
HETATM   30  H   UNL     1       3.172   3.935  -0.003  1.00  0.00           H  
HETATM   31  H   UNL     1       0.751   5.088   0.057  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.804   4.140   0.277  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.391  -1.969  -1.204  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.666  -1.578  -1.396  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.320  -1.907   1.037  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.046  -2.298   1.229  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.429  -5.568   0.853  1.00  0.00           H  
CONECT    1    2    2    7   26                                       
CONECT    2    1    1    3   27                                       
CONECT    3    2    4    5    5                                       
CONECT    4    3                                                      
CONECT    5    3    3    6   28                                       
CONECT    6    5    7    7   29                                       
CONECT    7    1    6    6    8                                       
CONECT    8    7    9   10   10                                       
CONECT    9    8   12                                                 
CONECT   10    8    8   11   30                                       
CONECT   11   10   12   12   31                                       
CONECT   12    9   11   11   13                                       
CONECT   13   12   14   14   32                                       
CONECT   14   13   13   15   17                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15                                                 
CONECT   17   14   18                                                 
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   15   18   21                                            
CONECT   21   20   22   33   34                                       
CONECT   22   21   23   35   36                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   37                                                 
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   13                                                      
CONECT   33   21                                                      
CONECT   34   21                                                      
CONECT   35   22                                                      
CONECT   36   22                                                      
CONECT   37   25                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
