COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.711  -0.761  -0.160  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.487  -0.302   1.053  1.00  0.00           C  
HETATM    3  O   UNL     1      -3.778   0.610  -2.130  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.560   0.240  -0.990  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.289   0.016  -0.645  1.00  0.00           N  
HETATM    6  C   UNL     1      -1.960  -0.397   0.561  1.00  0.00           C  
HETATM    7  S   UNL     1      -0.328  -0.680   0.993  1.00  0.00           S  
HETATM    8  C   UNL     1       0.488  -0.256  -0.566  1.00  0.00           C  
HETATM    9  C   UNL     1       1.977  -0.435  -0.419  1.00  0.00           C  
HETATM   10  C   UNL     1       2.559  -1.654  -0.714  1.00  0.00           C  
HETATM   11  C   UNL     1       3.924  -1.819  -0.579  1.00  0.00           C  
HETATM   12  C   UNL     1       4.131   0.459   0.130  1.00  0.00           C  
HETATM   13  C   UNL     1       2.763   0.623   0.000  1.00  0.00           C  
HETATM   14 CL   UNL     1       2.033   2.156   0.363  1.00  0.00          Cl  
HETATM   15  C   UNL     1      -3.087  -0.593   1.559  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.612   0.087  -0.177  1.00  0.00           N  
HETATM   17  H   UNL     1       5.778  -0.891  -0.055  1.00  0.00           H  
HETATM   18  H   UNL     1      -5.349  -0.419   1.693  1.00  0.00           H  
HETATM   19  H   UNL     1       0.119  -0.908  -1.358  1.00  0.00           H  
HETATM   20  H   UNL     1       0.270   0.782  -0.820  1.00  0.00           H  
HETATM   21  H   UNL     1       1.946  -2.478  -1.049  1.00  0.00           H  
HETATM   22  H   UNL     1       4.378  -2.773  -0.802  1.00  0.00           H  
HETATM   23  H   UNL     1       4.745   1.285   0.458  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.895   0.050   2.417  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.059  -1.627   1.903  1.00  0.00           H  
CONECT    1   12   12   11   17                                       
CONECT    2   15   16   16   18                                       
CONECT    3    4    4                                                 
CONECT    4   16    5    3    3                                       
CONECT    5    6    6    4                                            
CONECT    6   15    7    5    5                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   19   20                                       
CONECT    9   13   13   10    8                                       
CONECT   10   11   11    9   21                                       
CONECT   11    1   10   10   22                                       
CONECT   12    1    1   13   23                                       
CONECT   13   12   14    9    9                                       
CONECT   14   13                                                      
CONECT   15    2    6   24   25                                       
CONECT   16    2    2    4                                            
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    8                                                      
CONECT   20    8                                                      
CONECT   21   10                                                      
CONECT   22   11                                                      
CONECT   23   12                                                      
CONECT   24   15                                                      
CONECT   25   15                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
