COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.348   0.934  -0.400  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.035   0.920   0.250  1.00  0.00           N  
HETATM    3  C   UNL     1       0.006   0.310  -0.349  1.00  0.00           C  
HETATM    4  O   UNL     1      -0.143  -0.228  -1.426  1.00  0.00           O  
HETATM    5  C   UNL     1       1.357   0.295   0.319  1.00  0.00           C  
HETATM    6  C   UNL     1       2.355  -0.456  -0.564  1.00  0.00           C  
HETATM    7  S   UNL     1       3.941  -0.602   0.305  1.00  0.00           S  
HETATM    8  C   UNL     1       1.839   1.733   0.525  1.00  0.00           C  
HETATM    9  B   UNL     1      -3.215  -0.256   0.145  1.00  0.00           B  
HETATM   10  O   UNL     1      -4.628  -0.135   0.207  1.00  0.00           O  
HETATM   11  O   UNL     1      -2.585  -1.453   0.577  1.00  0.00           O  
HETATM   12  H   UNL     1      -2.850   1.877  -0.185  1.00  0.00           H  
HETATM   13  H   UNL     1      -2.222   0.827  -1.477  1.00  0.00           H  
HETATM   14  H   UNL     1      -0.916   1.350   1.111  1.00  0.00           H  
HETATM   15  H   UNL     1       1.279  -0.204   1.285  1.00  0.00           H  
HETATM   16  H   UNL     1       1.969  -1.451  -0.784  1.00  0.00           H  
HETATM   17  H   UNL     1       2.500   0.092  -1.495  1.00  0.00           H  
HETATM   18  H   UNL     1       4.707  -1.271  -0.575  1.00  0.00           H  
HETATM   19  H   UNL     1       2.816   1.722   1.009  1.00  0.00           H  
HETATM   20  H   UNL     1       1.917   2.232  -0.440  1.00  0.00           H  
HETATM   21  H   UNL     1       1.128   2.268   1.155  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.075  -0.919   0.556  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.200  -2.128   0.896  1.00  0.00           H  
CONECT    1    9    2   12   13                                       
CONECT    2    1    3   14                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    6    3    8   15                                       
CONECT    6    7    5   16   17                                       
CONECT    7    6   18                                                 
CONECT    8    5   19   20   21                                       
CONECT    9   11    1   10                                            
CONECT   10    9   22                                                 
CONECT   11    9   23                                                 
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20    8                                                      
CONECT   21    8                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
