COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.765   1.016  -0.004  1.00  0.00           C  
HETATM    2  N   UNL     1       3.892   0.256   0.007  1.00  0.00           N  
HETATM    3  C   UNL     1       3.508  -1.048   0.015  1.00  0.00           C  
HETATM    4  N   UNL     1       2.208  -1.107   0.009  1.00  0.00           N  
HETATM    5  C   UNL     1       1.708   0.154  -0.003  1.00  0.00           C  
HETATM    6  O   UNL     1      -0.041   1.698  -0.013  1.00  0.00           O  
HETATM    7  C   UNL     1       0.282   0.525  -0.008  1.00  0.00           C  
HETATM    8  S   UNL     1      -0.955  -0.730  -0.006  1.00  0.00           S  
HETATM    9  C   UNL     1      -2.445   0.298  -0.013  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.684  -0.600  -0.012  1.00  0.00           C  
HETATM   11  N   UNL     1      -4.893   0.234  -0.018  1.00  0.00           N  
HETATM   12  H   UNL     1       2.716   2.095  -0.008  1.00  0.00           H  
HETATM   13  H   UNL     1       4.805   0.584   0.009  1.00  0.00           H  
HETATM   14  H   UNL     1       4.175  -1.897   0.024  1.00  0.00           H  
HETATM   15  H   UNL     1      -2.454   0.930   0.875  1.00  0.00           H  
HETATM   16  H   UNL     1      -2.451   0.924  -0.905  1.00  0.00           H  
HETATM   17  H   UNL     1      -3.674  -1.233  -0.900  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.678  -1.226   0.880  1.00  0.00           H  
HETATM   19  H   UNL     1      -5.726  -0.336  -0.018  1.00  0.00           H  
HETATM   20  H   UNL     1      -4.894   0.875   0.761  1.00  0.00           H  
CONECT    1    2    5    5   12                                       
CONECT    2    3    1   13                                            
CONECT    3    2    4    4   14                                       
CONECT    4    3    3    5                                            
CONECT    5    1    1    4    7                                       
CONECT    6    7    7                                                 
CONECT    7    5    6    6    8                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   15   16                                       
CONECT   10    9   11   17   18                                       
CONECT   11   10   19   20                                            
CONECT   12    1                                                      
CONECT   13    2                                                      
CONECT   14    3                                                      
CONECT   15    9                                                      
CONECT   16    9                                                      
CONECT   17   10                                                      
CONECT   18   10                                                      
CONECT   19   11                                                      
CONECT   20   11                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
