COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNK     1       4.367   1.563  -0.635  1.00  0.00           O  
HETATM    2  N   UNK     1       2.981  -1.710   0.246  1.00  0.00           N  
HETATM    3  C   UNK     1       2.873  -0.386  -0.381  1.00  0.00           C  
HETATM    4  C   UNK     1       4.016   0.482   0.079  1.00  0.00           C  
HETATM    5  O   UNK     1       4.617   0.204   1.090  1.00  0.00           O  
HETATM    6  C   UNK     1       1.547   0.262   0.022  1.00  0.00           C  
HETATM    7  S   UNK     1       0.171  -0.783  -0.532  1.00  0.00           S  
HETATM    8  C   UNK     1      -1.290   0.137   0.028  1.00  0.00           C  
HETATM    9  C   UNK     1      -2.555  -0.626  -0.370  1.00  0.00           C  
HETATM   10  B   UNK     1      -3.841   0.183   0.123  1.00  0.00           B1-
HETATM   11  O   UNK     1      -3.852   1.419  -0.460  1.00  0.00           O  
HETATM   12  O   UNK     1      -4.971  -0.499  -0.232  1.00  0.00           O  
HETATM   13  O   UNK     1      -3.799   0.320   1.482  1.00  0.00           O  
HETATM   14  H   UNK     1       5.106   2.089  -0.300  1.00  0.00           H  
HETATM   15  H   UNK     1       3.818  -2.186  -0.056  1.00  0.00           H  
HETATM   16  H   UNK     1       2.948  -1.638   1.252  1.00  0.00           H  
HETATM   17  H   UNK     1       2.911  -0.493  -1.465  1.00  0.00           H  
HETATM   18  H   UNK     1       1.509   0.369   1.106  1.00  0.00           H  
HETATM   19  H   UNK     1       1.467   1.245  -0.443  1.00  0.00           H  
HETATM   20  H   UNK     1      -1.257   0.246   1.112  1.00  0.00           H  
HETATM   21  H   UNK     1      -1.299   1.122  -0.438  1.00  0.00           H  
HETATM   22  H   UNK     1      -2.588  -0.736  -1.453  1.00  0.00           H  
HETATM   23  H   UNK     1      -2.546  -1.612   0.096  1.00  0.00           H  
HETATM   24  H   UNK     1      -4.607   1.967  -0.206  1.00  0.00           H  
HETATM   25  H   UNK     1      -5.067  -0.634  -1.185  1.00  0.00           H  
HETATM   26  H   UNK     1      -3.022   0.796   1.806  1.00  0.00           H  
CONECT    1    4   14                                                 
CONECT    2    3   15   16                                            
CONECT    3    2    4    6   17                                       
CONECT    4    1    3    5    5                                       
CONECT    5    4    4                                                 
CONECT    6    3    7   18   19                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   20   21                                       
CONECT    9    8   10   22   23                                       
CONECT   10    9   11   12   13                                       
CONECT   11   10   24                                                 
CONECT   12   10   25                                                 
CONECT   13   10   26                                                 
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    2                                                      
CONECT   17    3                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    8                                                      
CONECT   21    8                                                      
CONECT   22    9                                                      
CONECT   23    9                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   13                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
