COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK     1       4.250  -0.356   0.055  1.00  0.00           C  
HETATM    2  C   UNK     1      -3.842  -0.488   0.072  1.00  0.00           C  
HETATM    3  N   UNK     1      -1.580  -1.207   0.593  1.00  0.00           N  
HETATM    4  N   UNK     1       1.984   0.425  -0.055  1.00  0.00           N  
HETATM    5  C   UNK     1       2.822  -0.537  -0.268  1.00  0.00           C  
HETATM    6  C   UNK     1      -2.464  -0.039   0.487  1.00  0.00           C  
HETATM    7  C   UNK     1      -1.907   0.929  -0.559  1.00  0.00           C  
HETATM    8  S   UNK     1      -0.249   1.469  -0.060  1.00  0.00           S  
HETATM    9  O   UNK     1       0.613   0.252  -0.365  1.00  0.00           O  
HETATM   10  O   UNK     1       4.639   0.697   0.520  1.00  0.00           O  
HETATM   11  O   UNK     1       5.122  -1.360  -0.162  1.00  0.00           O  
HETATM   12  O   UNK     1      -3.993  -1.563  -0.458  1.00  0.00           O  
HETATM   13  H   UNK     1      -1.891  -1.831   1.323  1.00  0.00           H  
HETATM   14  H   UNK     1      -1.511  -1.690  -0.290  1.00  0.00           H  
HETATM   15  H   UNK     1       2.476  -1.472  -0.681  1.00  0.00           H  
HETATM   16  H   UNK     1      -2.521   0.463   1.453  1.00  0.00           H  
HETATM   17  H   UNK     1      -1.851   0.427  -1.525  1.00  0.00           H  
HETATM   18  H   UNK     1      -2.563   1.796  -0.638  1.00  0.00           H  
HETATM   19  H   UNK     1       6.047  -1.195   0.065  1.00  0.00           H  
HETATM   20  O   UNK     1      -4.901   0.307   0.292  1.00  0.00           O  
HETATM   21  H   UNK     1      -5.765  -0.024   0.009  1.00  0.00           H  
CONECT    1   10   10   11    5                                       
CONECT    2    6   12   12   20                                       
CONECT    3    6   13   14                                            
CONECT    4    5    5    9                                            
CONECT    5    1    4    4   15                                       
CONECT    6    7    3    2   16                                       
CONECT    7    8    6   17   18                                       
CONECT    8    9    7                                                 
CONECT    9    4    8                                                 
CONECT   10    1    1                                                 
CONECT   11    1   19                                                 
CONECT   12    2    2                                                 
CONECT   13    3                                                      
CONECT   14    3                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    7                                                      
CONECT   18    7                                                      
CONECT   19   11                                                      
CONECT   20    2   21                                                 
CONECT   21   20                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
