COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.052   1.406  -0.134  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.679   0.101  -0.432  1.00  0.00           C  
HETATM    3  C   UNL     1       3.174  -0.451  -0.242  1.00  0.00           C  
HETATM    4  C   UNL     1       4.158  -0.863   0.855  1.00  0.00           C  
HETATM    5  C   UNL     1       3.389  -1.331  -1.476  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.612  -0.919  -0.366  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.930  -0.631   0.001  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.294   0.686   0.300  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.353   1.692   0.235  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.929  -1.709   0.073  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.050   2.493  -0.206  1.00  0.00           N1+
HETATM   12  O   UNL     1       1.098   2.243  -0.525  1.00  0.00           O  
HETATM   13  O   UNL     1       0.603  -0.173  -0.789  1.00  0.00           O  
HETATM   14  O   UNL     1       1.156  -2.037   0.484  1.00  0.00           O  
HETATM   15  O   UNL     1       1.206   0.255   1.415  1.00  0.00           O  
HETATM   16  O   UNL     1      -0.374   3.638   0.056  1.00  0.00           O1-
HETATM   17  S   UNL     1       1.476  -0.659   0.360  1.00  0.00           S  
HETATM   18  H   UNL     1       3.341   0.593  -0.507  1.00  0.00           H  
HETATM   19  H   UNL     1       3.991  -1.907   1.119  1.00  0.00           H  
HETATM   20  H   UNL     1       5.179  -0.738   0.493  1.00  0.00           H  
HETATM   21  H   UNL     1       4.005  -0.236   1.733  1.00  0.00           H  
HETATM   22  H   UNL     1       2.750  -0.981  -2.287  1.00  0.00           H  
HETATM   23  H   UNL     1       4.432  -1.274  -1.785  1.00  0.00           H  
HETATM   24  H   UNL     1       3.137  -2.363  -1.234  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.323  -1.933  -0.599  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.311   0.914   0.585  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.636   2.708   0.467  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.946  -1.485   0.358  1.00  0.00           H  
HETATM   29  O   UNL     1      -3.610  -2.850  -0.186  1.00  0.00           O  
CONECT    1    9    9    2   11                                       
CONECT    2    6    6    1   13                                       
CONECT    3    4   17    5   18                                       
CONECT    4    3   19   20   21                                       
CONECT    5    3   22   23   24                                       
CONECT    6    7    2    2   25                                       
CONECT    7   10    8    8    6                                       
CONECT    8    7    7    9   26                                       
CONECT    9    8    1    1   27                                       
CONECT   10    7   28   29   29                                       
CONECT   11    1   16   12   12                                       
CONECT   12   11   11                                                 
CONECT   13    2   17                                                 
CONECT   14   17   17                                                 
CONECT   15   17   17                                                 
CONECT   16   11                                                      
CONECT   17    3   15   15   13                                       
CONECT   17   14   14                                                 
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    4                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    5                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   10   10                                                 
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
