COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.417  -2.093  -0.208  1.00  0.00           C  
HETATM    2  N   UNL     1       2.341  -1.292   0.382  1.00  0.00           N  
HETATM    3  C   UNL     1       2.168  -0.011   0.000  1.00  0.00           C  
HETATM    4  O   UNL     1       2.904   0.479  -0.831  1.00  0.00           O  
HETATM    5  C   UNL     1       1.062   0.813   0.606  1.00  0.00           C  
HETATM    6  C   UNL     1       1.083   2.221   0.007  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.169   2.983   0.452  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.393   2.384  -0.250  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.358   0.884  -0.083  1.00  0.00           C  
HETATM   10  S   UNL     1      -2.699  -0.223  -0.346  1.00  0.00           S  
HETATM   11  C   UNL     1      -1.702  -1.545   0.076  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.144  -2.985   0.103  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.518  -1.132   0.367  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.282   0.170   0.296  1.00  0.00           C  
HETATM   15  H   UNL     1       3.400  -3.095   0.220  1.00  0.00           H  
HETATM   16  H   UNL     1       3.274  -2.156  -1.286  1.00  0.00           H  
HETATM   17  H   UNL     1       4.378  -1.623   0.004  1.00  0.00           H  
HETATM   18  H   UNL     1       1.753  -1.684   1.046  1.00  0.00           H  
HETATM   19  H   UNL     1       1.200   0.873   1.686  1.00  0.00           H  
HETATM   20  H   UNL     1       1.972   2.749   0.352  1.00  0.00           H  
HETATM   21  H   UNL     1       1.100   2.153  -1.081  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.287   2.892   1.532  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.071   4.035   0.183  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.303   2.781   0.199  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.368   2.638  -1.310  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.193  -3.049  -0.187  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.539  -3.564  -0.595  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.020  -3.385   1.110  1.00  0.00           H  
CONECT    1    2   15   16   17                                       
CONECT    2    3    1   18                                            
CONECT    3    4    4    2    5                                       
CONECT    4    3    3                                                 
CONECT    5    3   14    6   19                                       
CONECT    6    7    5   20   21                                       
CONECT    7    8    6   22   23                                       
CONECT    8    9    7   24   25                                       
CONECT    9   10   14   14    8                                       
CONECT   10   11    9                                                 
CONECT   11   12   10   13   13                                       
CONECT   12   11   26   27   28                                       
CONECT   13   11   11   14                                            
CONECT   14   13    9    9    5                                       
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    5                                                      
CONECT   20    6                                                      
CONECT   21    6                                                      
CONECT   22    7                                                      
CONECT   23    7                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
CONECT   28   12                                                      
MASTER        0    0    0    0    0    0    0    0   28    0   28    0
END
