COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.313  -1.063  -0.647  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.420  -0.176  -0.182  1.00  0.00           C  
HETATM    3  O   UNL     1      -3.784   0.926   0.156  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.965  -0.553  -0.080  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.741  -1.385   1.185  1.00  0.00           C  
HETATM    6  S   UNL     1      -0.954   0.951  -0.002  1.00  0.00           S  
HETATM    7  C   UNL     1       0.692   0.324  -0.037  1.00  0.00           C  
HETATM    8  C   UNL     1       1.803   1.212   0.008  1.00  0.00           C  
HETATM    9  O   UNL     1       1.640   2.419   0.072  1.00  0.00           O  
HETATM   10  N   UNL     1       3.045   0.676  -0.022  1.00  0.00           N  
HETATM   11  C   UNL     1       3.168  -0.678  -0.093  1.00  0.00           C  
HETATM   12  O   UNL     1       4.398  -1.237  -0.124  1.00  0.00           O  
HETATM   13  N   UNL     1       2.103  -1.448  -0.132  1.00  0.00           N  
HETATM   14  N   UNL     1       0.911  -0.972  -0.101  1.00  0.00           N  
HETATM   15  H   UNL     1      -5.235  -0.775  -0.694  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.679  -1.138  -0.954  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.688  -1.658   1.259  1.00  0.00           H  
HETATM   18  H   UNL     1      -2.027  -0.800   2.059  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.349  -2.289   1.138  1.00  0.00           H  
HETATM   20  H   UNL     1       3.830   1.245   0.007  1.00  0.00           H  
HETATM   21  H   UNL     1       4.390  -2.202  -0.175  1.00  0.00           H  
CONECT    1    2   15                                                 
CONECT    2    4    3    3    1                                       
CONECT    3    2    2                                                 
CONECT    4    5    2    6   16                                       
CONECT    5    4   17   18   19                                       
CONECT    6    4    7                                                 
CONECT    7   14   14    6    8                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8                                                 
CONECT   10   11    8   20                                            
CONECT   11   13   13   12   10                                       
CONECT   12   11   21                                                 
CONECT   13   14   11   11                                            
CONECT   14   13    7    7                                            
CONECT   15    1                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20   10                                                      
CONECT   21   12                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
