COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.759   0.749  -4.031  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.751   0.119  -5.262  1.00  0.00           C  
HETATM    3  C   UNL     1       0.314  -0.645  -5.602  1.00  0.00           C  
HETATM    4  S   UNL     1       1.359  -0.483  -4.164  1.00  0.00           S  
HETATM    5  C   UNL     1       0.304   0.592  -3.206  1.00  0.00           C  
HETATM    6  C   UNL     1       0.534   1.170  -1.833  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.016   0.229  -0.793  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.543  -0.809  -1.133  1.00  0.00           O  
HETATM    9  N   UNL     1       0.076   0.540   0.514  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.458  -0.374   1.525  1.00  0.00           C  
HETATM   11  B   UNL     1      -1.958  -0.013   1.815  1.00  0.00           B  
HETATM   12  O   UNL     1      -2.296   1.275   2.306  1.00  0.00           O  
HETATM   13  O   UNL     1      -2.977  -0.976   1.588  1.00  0.00           O  
HETATM   14  C   UNL     1       0.344  -0.245   2.794  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.256  -0.475   4.018  1.00  0.00           C  
HETATM   16  C   UNL     1       1.681   0.097   2.734  1.00  0.00           C  
HETATM   17  C   UNL     1       2.416   0.219   3.898  1.00  0.00           C  
HETATM   18  C   UNL     1       1.816  -0.009   5.122  1.00  0.00           C  
HETATM   19  C   UNL     1       0.479  -0.357   5.182  1.00  0.00           C  
HETATM   20  H   UNL     1      -1.596   1.364  -3.736  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.584   0.231  -5.940  1.00  0.00           H  
HETATM   22  H   UNL     1       0.487  -1.206  -6.509  1.00  0.00           H  
HETATM   23  H   UNL     1       0.029   2.133  -1.756  1.00  0.00           H  
HETATM   24  H   UNL     1       1.603   1.306  -1.671  1.00  0.00           H  
HETATM   25  H   UNL     1       0.498   1.371   0.785  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.395  -1.398   1.158  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.469   1.768   2.389  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.539  -1.773   1.259  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.300  -0.747   4.064  1.00  0.00           H  
HETATM   30  H   UNL     1       2.150   0.277   1.778  1.00  0.00           H  
HETATM   31  H   UNL     1       3.460   0.492   3.852  1.00  0.00           H  
HETATM   32  H   UNL     1       2.391   0.083   6.032  1.00  0.00           H  
HETATM   33  H   UNL     1       0.010  -0.537   6.138  1.00  0.00           H  
CONECT    1    2    5    5   20                                       
CONECT    2    1    3    3   21                                       
CONECT    3    2    2    4   22                                       
CONECT    4    3    5                                                 
CONECT    5    1    1    4    6                                       
CONECT    6    5    7   23   24                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   25                                            
CONECT   10    9   11   14   26                                       
CONECT   11   10   12   13                                            
CONECT   12   11   27                                                 
CONECT   13   11   28                                                 
CONECT   14   10   15   15   16                                       
CONECT   15   14   14   19   29                                       
CONECT   16   14   17   17   30                                       
CONECT   17   16   16   18   31                                       
CONECT   18   17   19   19   32                                       
CONECT   19   15   18   18   33                                       
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   17                                                      
CONECT   32   18                                                      
CONECT   33   19                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
