COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.937   0.085  -0.944  1.00  0.00           O  
HETATM    2  C   UNL     1       3.333   0.794  -0.168  1.00  0.00           C  
HETATM    3  N   UNL     1       3.888   1.943   0.267  1.00  0.00           N  
HETATM    4  O   UNL     1       5.176   2.321  -0.184  1.00  0.00           O  
HETATM    5  C   UNL     1       1.960   0.395   0.307  1.00  0.00           C  
HETATM    6  N   UNL     1       1.582  -0.879  -0.309  1.00  0.00           N  
HETATM    7  S   UNL     1       0.307  -1.746   0.296  1.00  0.00           S  
HETATM    8  O   UNL     1       0.176  -2.896  -0.528  1.00  0.00           O  
HETATM    9  O   UNL     1       0.501  -1.816   1.702  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.146  -0.783   0.042  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.871  -0.924  -1.127  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.011  -0.170  -1.329  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.428   0.729  -0.358  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.549   1.471  -0.554  1.00  0.00           O  
HETATM   15  C   UNL     1      -4.919   2.376   0.488  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.699   0.868   0.814  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.563   0.108   1.013  1.00  0.00           C  
HETATM   18  H   UNL     1       3.406   2.510   0.888  1.00  0.00           H  
HETATM   19  H   UNL     1       5.490   3.160   0.182  1.00  0.00           H  
HETATM   20  H   UNL     1       1.968   0.285   1.391  1.00  0.00           H  
HETATM   21  H   UNL     1       1.240   1.163   0.024  1.00  0.00           H  
HETATM   22  H   UNL     1       2.078  -1.215  -1.072  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.546  -1.624  -1.883  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.577  -0.280  -2.243  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.829   2.905   0.205  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.094   1.819   1.408  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.115   3.095   0.647  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.021   1.567   1.571  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.997   0.212   1.928  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    5                                       
CONECT    3    2    4   18                                            
CONECT    4    3   19                                                 
CONECT    5    2    6   20   21                                       
CONECT    6    5    7   22                                            
CONECT    7    6    8    8    9                                       
CONECT    7    9   10                                                 
CONECT    8    7    7                                                 
CONECT    9    7    7                                                 
CONECT   10    7   11   11   17                                       
CONECT   11   10   10   12   23                                       
CONECT   12   11   13   13   24                                       
CONECT   13   12   12   14   16                                       
CONECT   14   13   15                                                 
CONECT   15   14   25   26   27                                       
CONECT   16   13   17   17   28                                       
CONECT   17   10   16   16   29                                       
CONECT   18    3                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23   11                                                      
CONECT   24   12                                                      
CONECT   25   15                                                      
CONECT   26   15                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
