COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.406   0.842   0.441  1.00  0.00           C  
HETATM    2  C   UNL     1       2.984  -1.201   0.161  1.00  0.00           C  
HETATM    3  C   UNL     1       1.761  -1.816   0.031  1.00  0.00           C  
HETATM    4  C   UNL     1       0.588  -1.056   0.033  1.00  0.00           C  
HETATM    5  C   UNL     1       3.060   0.178   0.299  1.00  0.00           C  
HETATM    6  C   UNL     1       1.930   0.937   0.310  1.00  0.00           C  
HETATM    7  C   UNL     1       0.662   0.334   0.167  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.655   0.949   0.150  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.659   0.108  -0.001  1.00  0.00           C  
HETATM   10  B   UNL     1      -3.156   0.529  -0.050  1.00  0.00           B1-
HETATM   11  O   UNL     1      -3.930  -0.483   0.444  1.00  0.00           O  
HETATM   12  O   UNL     1      -3.338   1.653   0.707  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.515   0.787  -1.343  1.00  0.00           O  
HETATM   14  S   UNL     1      -1.094  -1.548  -0.112  1.00  0.00           S  
HETATM   15  N   UNL     1       4.922   1.191  -0.890  1.00  0.00           N  
HETATM   16  H   UNL     1       4.304   1.746   1.040  1.00  0.00           H  
HETATM   17  H   UNL     1       5.099   0.157   0.930  1.00  0.00           H  
HETATM   18  H   UNL     1       3.888  -1.792   0.159  1.00  0.00           H  
HETATM   19  H   UNL     1       1.707  -2.890  -0.072  1.00  0.00           H  
HETATM   20  H   UNL     1       2.004   2.009   0.419  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.800   2.014   0.254  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.878  -0.289   0.444  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.103   1.543   1.638  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.411   0.032  -1.939  1.00  0.00           H  
HETATM   25  H   UNL     1       5.824   1.638  -0.822  1.00  0.00           H  
HETATM   26  H   UNL     1       4.964   0.379  -1.486  1.00  0.00           H  
CONECT    1   15    5   16   17                                       
CONECT    2    5    5    3   18                                       
CONECT    3    2    4    4   19                                       
CONECT    4    3    3    7   14                                       
CONECT    5    1    2    2    6                                       
CONECT    6    5    7    7   20                                       
CONECT    7    6    6    4    8                                       
CONECT    8    7    9    9   21                                       
CONECT    9    8    8   14   10                                       
CONECT   10    9   11   13   12                                       
CONECT   11   10   22                                                 
CONECT   12   10   23                                                 
CONECT   13   10   24                                                 
CONECT   14    4    9                                                 
CONECT   15    1   25   26                                            
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    6                                                      
CONECT   21    8                                                      
CONECT   22   11                                                      
CONECT   23   12                                                      
CONECT   24   13                                                      
CONECT   25   15                                                      
CONECT   26   15                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
