COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.202   1.389  -0.650  1.00  0.00           C  
HETATM    2  N   UNL     1       2.427  -0.026  -0.325  1.00  0.00           N  
HETATM    3  C   UNL     1       3.848  -0.287  -0.062  1.00  0.00           C  
HETATM    4  C   UNL     1       1.596  -0.443   0.812  1.00  0.00           C  
HETATM    5  C   UNL     1       0.142  -0.392   0.418  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.523  -1.460  -0.024  1.00  0.00           C  
HETATM    7  S   UNL     1      -2.179  -0.969  -0.370  1.00  0.00           S  
HETATM    8  C   UNL     1      -1.817   0.630   0.115  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.719   1.683   0.115  1.00  0.00           N  
HETATM   10  N   UNL     1      -0.578   0.714   0.487  1.00  0.00           N  
HETATM   11  H   UNL     1       2.776   1.653  -1.538  1.00  0.00           H  
HETATM   12  H   UNL     1       1.142   1.554  -0.840  1.00  0.00           H  
HETATM   13  H   UNL     1       2.523   2.009   0.188  1.00  0.00           H  
HETATM   14  H   UNL     1       4.162   0.268   0.822  1.00  0.00           H  
HETATM   15  H   UNL     1       3.997  -1.354   0.107  1.00  0.00           H  
HETATM   16  H   UNL     1       4.441   0.031  -0.920  1.00  0.00           H  
HETATM   17  H   UNL     1       1.858  -1.461   1.100  1.00  0.00           H  
HETATM   18  H   UNL     1       1.768   0.228   1.654  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.116  -2.453  -0.149  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.633   1.539  -0.176  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.436   2.564   0.405  1.00  0.00           H  
CONECT    1    2   11   12   13                                       
CONECT    2    1    3    4                                            
CONECT    3    2   14   15   16                                       
CONECT    4    2    5   17   18                                       
CONECT    5    6    6    4   10                                       
CONECT    6    7    5    5   19                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   10   10                                       
CONECT    9    8   20   21                                            
CONECT   10    5    8    8                                            
CONECT   11    1                                                      
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    3                                                      
CONECT   15    3                                                      
CONECT   16    3                                                      
CONECT   17    4                                                      
CONECT   18    4                                                      
CONECT   19    6                                                      
CONECT   20    9                                                      
CONECT   21    9                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
