COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.617   0.662   0.143  1.00  0.00           N  
HETATM    2  C   UNL     1       3.381  -1.962   0.634  1.00  0.00           C  
HETATM    3  C   UNL     1       3.350  -0.844  -0.410  1.00  0.00           C  
HETATM    4  C   UNL     1       2.099  -0.022  -0.229  1.00  0.00           C  
HETATM    5  C   UNL     1       2.140   1.303  -0.062  1.00  0.00           C  
HETATM    6  S   UNL     1       0.487   1.888   0.113  1.00  0.00           S  
HETATM    7  C   UNL     1      -0.111   0.240  -0.062  1.00  0.00           C  
HETATM    8  N   UNL     1       0.902  -0.564  -0.231  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.526  -0.164  -0.029  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.018  -1.429  -0.160  1.00  0.00           C  
HETATM   11  N   UNL     1      -3.350  -1.363  -0.071  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.716  -0.122   0.110  1.00  0.00           C  
HETATM   13  H   UNL     1      -2.598   1.623   0.268  1.00  0.00           H  
HETATM   14  H   UNL     1       3.375  -1.526   1.633  1.00  0.00           H  
HETATM   15  H   UNL     1       2.506  -2.599   0.510  1.00  0.00           H  
HETATM   16  H   UNL     1       4.285  -2.556   0.503  1.00  0.00           H  
HETATM   17  H   UNL     1       4.225  -0.206  -0.287  1.00  0.00           H  
HETATM   18  H   UNL     1       3.356  -1.280  -1.409  1.00  0.00           H  
HETATM   19  H   UNL     1       3.032   1.911  -0.037  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.434  -2.326  -0.310  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.734   0.222   0.220  1.00  0.00           H  
CONECT    1    9   12   13                                            
CONECT    2    3   14   15   16                                       
CONECT    3    2    4   17   18                                       
CONECT    4    5    5    3    8                                       
CONECT    5    4    4    6   19                                       
CONECT    6    5    7                                                 
CONECT    7    6    8    8    9                                       
CONECT    8    4    7    7                                            
CONECT    9    7   10   10    1                                       
CONECT   10    9    9   11   20                                       
CONECT   11   10   12   12                                            
CONECT   12    1   11   11   21                                       
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    2                                                      
CONECT   16    2                                                      
CONECT   17    3                                                      
CONECT   18    3                                                      
CONECT   19    5                                                      
CONECT   20   10                                                      
CONECT   21   12                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
