COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.907   0.702   0.000  1.00  0.00           C  
HETATM    2  N   UNL     1       0.600   1.061   0.002  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.152  -0.014  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.629  -0.018  -0.001  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.341   1.155   0.003  1.00  0.00           C  
HETATM    6  S   UNL     1      -4.013   0.524   0.002  1.00  0.00           S  
HETATM    7  C   UNL     1      -3.620  -1.167  -0.004  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.311  -1.155  -0.010  1.00  0.00           N  
HETATM    9  N   UNL     1       0.639  -1.132   0.007  1.00  0.00           N  
HETATM   10  C   UNL     1       1.953  -0.703   0.004  1.00  0.00           C  
HETATM   11  C   UNL     1       3.177  -1.356   0.003  1.00  0.00           C  
HETATM   12  C   UNL     1       4.346  -0.623  -0.001  1.00  0.00           C  
HETATM   13  C   UNL     1       4.307   0.764  -0.004  1.00  0.00           C  
HETATM   14  C   UNL     1       3.102   1.429  -0.004  1.00  0.00           C  
HETATM   15  H   UNL     1      -1.989   2.176   0.007  1.00  0.00           H  
HETATM   16  H   UNL     1      -4.288  -2.016  -0.006  1.00  0.00           H  
HETATM   17  H   UNL     1       0.334  -2.053   0.009  1.00  0.00           H  
HETATM   18  H   UNL     1       3.215  -2.435   0.006  1.00  0.00           H  
HETATM   19  H   UNL     1       5.298  -1.133  -0.001  1.00  0.00           H  
HETATM   20  H   UNL     1       5.229   1.326  -0.007  1.00  0.00           H  
HETATM   21  H   UNL     1       3.079   2.509  -0.006  1.00  0.00           H  
CONECT    1    2   10   10   14                                       
CONECT    2    1    3    3                                            
CONECT    3    2    2    4    9                                       
CONECT    4    3    5    5    8                                       
CONECT    5    4    4    6   15                                       
CONECT    6    5    7                                                 
CONECT    7    6    8    8   16                                       
CONECT    8    4    7    7                                            
CONECT    9    3   10   17                                            
CONECT   10    1    1    9   11                                       
CONECT   11   10   12   12   18                                       
CONECT   12   11   11   13   19                                       
CONECT   13   12   14   14   20                                       
CONECT   14    1   13   13   21                                       
CONECT   15    5                                                      
CONECT   16    7                                                      
CONECT   17    9                                                      
CONECT   18   11                                                      
CONECT   19   12                                                      
CONECT   20   13                                                      
CONECT   21   14                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
