COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.131   1.584  -0.159  1.00  0.00           C  
HETATM    2  C   UNL     1       3.118   2.514   0.038  1.00  0.00           C  
HETATM    3  C   UNL     1       1.825   2.111   0.163  1.00  0.00           C  
HETATM    4  C   UNL     1       2.509  -0.193  -0.101  1.00  0.00           C  
HETATM    5  C   UNL     1       0.209  -1.248   0.097  1.00  0.00           C  
HETATM    6  C   UNL     1       0.179   0.112   0.208  1.00  0.00           C  
HETATM    7  B   UNL     1      -1.055  -2.175   0.179  1.00  0.00           B  
HETATM    8  C   UNL     1       1.491   0.742   0.097  1.00  0.00           C  
HETATM    9  S   UNL     1       1.846  -1.822  -0.148  1.00  0.00           S  
HETATM   10  C   UNL     1       3.834   0.244  -0.228  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.057   0.870   0.419  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.131   0.647  -0.374  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.364   1.404  -0.163  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.914  -3.583   0.051  1.00  0.00           O  
HETATM   15  O   UNL     1      -2.341  -1.607   0.381  1.00  0.00           O  
HETATM   16  O   UNL     1      -3.425   2.233   0.724  1.00  0.00           O  
HETATM   17  O   UNL     1      -4.435   1.182  -0.954  1.00  0.00           O  
HETATM   18  H   UNL     1       5.154   1.914  -0.262  1.00  0.00           H  
HETATM   19  H   UNL     1       3.360   3.565   0.091  1.00  0.00           H  
HETATM   20  H   UNL     1       1.048   2.845   0.316  1.00  0.00           H  
HETATM   21  H   UNL     1       4.625  -0.474  -0.385  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.111   1.606   1.207  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.077  -0.089  -1.162  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.747  -4.069   0.115  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.057  -2.256   0.417  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.202   1.729  -0.739  1.00  0.00           H  
CONECT    1    2    2   10   18                                       
CONECT    2    1    1    3   19                                       
CONECT    3    2    8    8   20                                       
CONECT    4   10   10    8    9                                       
CONECT    5    6    6    9    7                                       
CONECT    6    8   11    5    5                                       
CONECT    7   14    5   15                                            
CONECT    8    3    3    4    6                                       
CONECT    9    4    5                                                 
CONECT   10    1    4    4   21                                       
CONECT   11   12   12    6   22                                       
CONECT   12   13   11   11   23                                       
CONECT   13   16   16   17   12                                       
CONECT   14    7   24                                                 
CONECT   15    7   25                                                 
CONECT   16   13   13                                                 
CONECT   17   13   26                                                 
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21   10                                                      
CONECT   22   11                                                      
CONECT   23   12                                                      
CONECT   24   14                                                      
CONECT   25   15                                                      
CONECT   26   17                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
