COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNK     1       2.423   1.952  -0.658  1.00  0.00           O  
HETATM    2  C   UNK     1       3.237   1.224  -0.140  1.00  0.00           C  
HETATM    3  O   UNK     1       4.427   1.713   0.244  1.00  0.00           O  
HETATM    4  C   UNK     1       2.914  -0.231   0.080  1.00  0.00           C  
HETATM    5  C   UNK     1       1.504  -0.525  -0.438  1.00  0.00           C  
HETATM    6  C   UNK     1       1.227  -2.002  -0.331  1.00  0.00           C  
HETATM    7  O   UNK     1       0.796  -2.606  -1.284  1.00  0.00           O  
HETATM    8  O   UNK     1       1.459  -2.647   0.823  1.00  0.00           O  
HETATM    9  S   UNK     1       0.293   0.391   0.555  1.00  0.00           S  
HETATM   10  C   UNK     1      -1.274   0.044  -0.291  1.00  0.00           C  
HETATM   11  C   UNK     1      -2.415   0.758   0.437  1.00  0.00           C  
HETATM   12  C   UNK     1      -3.717   0.469  -0.266  1.00  0.00           C  
HETATM   13  O   UNK     1      -4.465  -0.373   0.170  1.00  0.00           O  
HETATM   14  N   UNK     1      -2.490   0.276   1.822  1.00  0.00           N  
HETATM   15  O   UNK     1      -4.045   1.149  -1.377  1.00  0.00           O  
HETATM   16  H   UNK     1       3.634  -0.848  -0.458  1.00  0.00           H  
HETATM   17  H   UNK     1       2.964  -0.458   1.145  1.00  0.00           H  
HETATM   18  H   UNK     1       1.428  -0.215  -1.480  1.00  0.00           H  
HETATM   19  H   UNK     1      -1.219   0.402  -1.319  1.00  0.00           H  
HETATM   20  H   UNK     1      -1.457  -1.030  -0.289  1.00  0.00           H  
HETATM   21  H   UNK     1      -2.231   1.832   0.435  1.00  0.00           H  
HETATM   22  H   UNK     1      -3.193   0.778   2.342  1.00  0.00           H  
HETATM   23  H   UNK     1      -2.659  -0.719   1.851  1.00  0.00           H  
HETATM   24  H   UNK     1       1.266  -3.594   0.844  1.00  0.00           H  
HETATM   25  H   UNK     1       4.587   2.654   0.086  1.00  0.00           H  
HETATM   26  H   UNK     1      -4.890   0.929  -1.792  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4    1    1    3                                       
CONECT    3    2   25                                                 
CONECT    4    5    2   16   17                                       
CONECT    5    6    9    4   18                                       
CONECT    6    7    7    8    5                                       
CONECT    7    6    6                                                 
CONECT    8    6   24                                                 
CONECT    9    5   10                                                 
CONECT   10    9   11   19   20                                       
CONECT   11   12   10   14   21                                       
CONECT   12   13   13   15   11                                       
CONECT   13   12   12                                                 
CONECT   14   11   22   23                                            
CONECT   15   12   26                                                 
CONECT   16    4                                                      
CONECT   17    4                                                      
CONECT   18    5                                                      
CONECT   19   10                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
CONECT   22   14                                                      
CONECT   23   14                                                      
CONECT   24    8                                                      
CONECT   25    3                                                      
CONECT   26   15                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
