COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.740  -1.181  -0.641  1.00  0.00           N  
HETATM    2  C   UNL     1       4.105   0.072  -0.211  1.00  0.00           C  
HETATM    3  C   UNL     1       2.612  -0.122  -0.136  1.00  0.00           C  
HETATM    4  O   UNL     1       2.149  -1.239  -0.052  1.00  0.00           O  
HETATM    5  C   UNL     1       4.638   0.467   1.168  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.311  -0.013  -0.355  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.863  -1.209   0.492  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.521   1.236   0.044  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.414  -1.516   0.161  1.00  0.00           C  
HETATM   10  C   UNL     1       0.417   0.769  -0.094  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.043   0.928   0.002  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.517  -0.339   0.052  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.181  -0.373  -0.003  1.00  0.00           N  
HETATM   14  N   UNL     1       1.792   0.947  -0.162  1.00  0.00           N  
HETATM   15  O   UNL     1      -2.016  -2.650  -0.005  1.00  0.00           O  
HETATM   16  S   UNL     1      -0.769   2.056  -0.115  1.00  0.00           S  
HETATM   17  H   UNL     1       4.543  -1.928   0.009  1.00  0.00           H  
HETATM   18  H   UNL     1       4.454  -1.430  -1.576  1.00  0.00           H  
HETATM   19  H   UNL     1       4.334   0.860  -0.928  1.00  0.00           H  
HETATM   20  H   UNL     1       5.718   0.607   1.114  1.00  0.00           H  
HETATM   21  H   UNL     1       4.167   1.396   1.487  1.00  0.00           H  
HETATM   22  H   UNL     1       4.409  -0.321   1.885  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.136  -0.230  -1.408  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.374   0.165  -0.194  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.952  -0.963   1.550  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.483  -2.075   0.260  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.744   2.045  -0.652  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.801   1.536   1.054  1.00  0.00           H  
HETATM   29  H   UNL     1       2.163   1.841  -0.230  1.00  0.00           H  
CONECT    1    2   17   18                                            
CONECT    2    5    3    1   19                                       
CONECT    3    4    4   14    2                                       
CONECT    4    3    3                                                 
CONECT    5    2   20   21   22                                       
CONECT    6    8    7   23   24                                       
CONECT    7    6    9   25   26                                       
CONECT    8    6   11   27   28                                       
CONECT    9    7   12   15   15                                       
CONECT   10   16   13   13   14                                       
CONECT   11    8   16   12   12                                       
CONECT   12   11   11    9   13                                       
CONECT   13   12   10   10                                            
CONECT   14   10    3   29                                            
CONECT   15    9    9                                                 
CONECT   16   11   10                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    8                                                      
CONECT   29   14                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
