D0M4EQ
AUTHOR    GENERATED BY OPEN BABEL 2.4.1
HETATM    1  N   UNL     1       1.354  -0.100   0.363  1.00  0.00           N  
HETATM    2  C   UNL     1       1.218  -0.538   1.684  1.00  0.00           C  
HETATM    3  N   UNL     1       2.519  -0.693   2.150  1.00  0.00           N  
HETATM    4  C   UNL     1       3.403  -0.361   1.150  1.00  0.00           C  
HETATM    5  C   UNL     1       2.697  -0.002   0.065  1.00  0.00           C  
HETATM    6  S   UNL     1      -0.174  -0.812   2.513  1.00  0.00           S  
HETATM    7  C   UNL     1       4.811  -0.411   1.303  1.00  0.00           C  
HETATM    8  C   UNL     1       5.831  -0.112   0.414  1.00  0.00           C  
HETATM    9  C   UNL     1       7.137  -0.297   0.967  1.00  0.00           C  
HETATM   10  C   UNL     1       7.089  -0.735   2.271  1.00  0.00           C  
HETATM   11  S   UNL     1       5.485  -0.918   2.812  1.00  0.00           S  
HETATM   12  C   UNL     1       8.207  -1.048   3.205  1.00  0.00           C  
HETATM   13  H   UNL     1       0.580   0.106  -0.254  1.00  0.00           H  
HETATM   14  H   UNL     1       2.785  -1.000   3.075  1.00  0.00           H  
HETATM   15  H   UNL     1       3.034   0.322  -0.907  1.00  0.00           H  
HETATM   16  H   UNL     1       5.660   0.229  -0.601  1.00  0.00           H  
HETATM   17  H   UNL     1       8.060  -0.116   0.430  1.00  0.00           H  
HETATM   18  H   UNL     1       9.178  -0.888   2.728  1.00  0.00           H  
HETATM   19  H   UNL     1       8.157  -2.093   3.529  1.00  0.00           H  
HETATM   20  H   UNL     1       8.157  -0.409   4.093  1.00  0.00           H  
CONECT    1    2    5   13                                            
CONECT    2    1    3    6                                            
CONECT    3    2    4   14                                            
CONECT    4    3    5    7                                            
CONECT    5    4    1   15                                            
CONECT    6    2                                                      
CONECT    7    4    8   11                                            
CONECT    8    7    9   16                                            
CONECT    9    8   10   17                                            
CONECT   10    9   11   12                                            
CONECT   11   10    7                                                 
CONECT   12   10   18   19   20                                       
CONECT   13    1                                                      
CONECT   14    3                                                      
CONECT   15    5                                                      
CONECT   16    8                                                      
CONECT   17    9                                                      
CONECT   18   12                                                      
CONECT   19   12                                                      
CONECT   20   12                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
M  END

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