COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.000   1.980  -3.099  1.00  0.00           C  
HETATM    2  C   UNL     1       2.272   1.694  -0.923  1.00  0.00           C  
HETATM    3  C   UNL     1       2.579   3.031  -0.728  1.00  0.00           C  
HETATM    4  C   UNL     1       2.576   3.847  -1.855  1.00  0.00           C  
HETATM    5  C   UNL     1       2.685   2.121   1.196  1.00  0.00           C  
HETATM    6  N   UNL     1       2.280   3.305  -3.061  1.00  0.00           N  
HETATM    7  O   UNL     1      -2.100  -2.246   0.247  1.00  0.00           O  
HETATM    8  P   UNL     1      -0.622  -2.846   0.504  1.00  0.00           P  
HETATM    9  O   UNL     1       0.175  -1.634   1.233  1.00  0.00           O  
HETATM   10  O   UNL     1      -0.570  -4.178   1.189  1.00  0.00           O  
HETATM   11  O   UNL     1       0.090  -2.760  -0.953  1.00  0.00           O  
HETATM   12  C   UNL     1       1.038  -1.695  -0.957  1.00  0.00           C  
HETATM   13  C   UNL     1       2.438  -2.191  -0.636  1.00  0.00           C  
HETATM   14  C   UNL     1       3.219  -2.615  -1.866  1.00  0.00           C  
HETATM   15  O   UNL     1       4.506  -3.047  -1.460  1.00  0.00           O  
HETATM   16  P   UNL     1       5.802  -2.270  -2.042  1.00  0.00           P  
HETATM   17  O   UNL     1       7.142  -2.767  -1.581  1.00  0.00           O  
HETATM   18  O   UNL     1       5.592  -2.322  -3.647  1.00  0.00           O  
HETATM   19  O   UNL     1       5.448  -0.730  -1.683  1.00  0.00           O  
HETATM   20  S   UNL     1       6.480   0.369  -2.310  1.00  0.00           S  
HETATM   21  O   UNL     1       6.469   0.253  -3.756  1.00  0.00           O  
HETATM   22  O   UNL     1       5.766   1.784  -1.928  1.00  0.00           O  
HETATM   23  O   UNL     1       7.728   0.299  -1.572  1.00  0.00           O  
HETATM   24  C   UNL     1       0.735  -0.780   0.222  1.00  0.00           C  
HETATM   25  C   UNL     1       2.104  -0.277   0.656  1.00  0.00           C  
HETATM   26  O   UNL     1       3.100  -1.090   0.003  1.00  0.00           O  
HETATM   27  N   UNL     1       2.344   1.125   0.318  1.00  0.00           N  
HETATM   28  N   UNL     1       2.834   3.283   0.596  1.00  0.00           N  
HETATM   29  N   UNL     1       2.876   5.217  -1.750  1.00  0.00           N  
HETATM   30  N   UNL     1       1.971   1.091  -2.082  1.00  0.00           N  
HETATM   31  H   UNL     1       1.767   1.579  -4.079  1.00  0.00           H  
HETATM   32  H   UNL     1       2.809   1.939   2.255  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.836  -2.538   0.826  1.00  0.00           H  
HETATM   34  H   UNL     1       1.001  -1.148  -1.905  1.00  0.00           H  
HETATM   35  H   UNL     1       2.416  -3.031   0.069  1.00  0.00           H  
HETATM   36  H   UNL     1       3.325  -1.773  -2.553  1.00  0.00           H  
HETATM   37  H   UNL     1       2.708  -3.436  -2.372  1.00  0.00           H  
HETATM   38  H   UNL     1       6.301  -1.975  -4.229  1.00  0.00           H  
HETATM   39  H   UNL     1       5.454   1.861  -0.996  1.00  0.00           H  
HETATM   40  H   UNL     1       0.002   0.002  -0.001  1.00  0.00           H  
HETATM   41  H   UNL     1       2.255  -0.346   1.738  1.00  0.00           H  
HETATM   42  H   UNL     1       3.501   5.531  -1.032  1.00  0.00           H  
HETATM   43  H   UNL     1       2.390   5.873  -2.331  1.00  0.00           H  
CONECT    1   30   30    6   31                                       
CONECT    2   27    3    3   30                                       
CONECT    3    2    2   28    4                                       
CONECT    4    3   29    6    6                                       
CONECT    5   28   28   27   32                                       
CONECT    6    1    4    4                                            
CONECT    7    8   33                                                 
CONECT    8    7   11   10   10                                       
CONECT    8    9                                                      
CONECT    9    8   24                                                 
CONECT   10    8    8                                                 
CONECT   11    8   12                                                 
CONECT   12   11   13   24   34                                       
CONECT   13   12   26   14   35                                       
CONECT   14   13   15   36   37                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   17   19                                       
CONECT   16   18                                                      
CONECT   17   16   16                                                 
CONECT   18   16   38                                                 
CONECT   19   16   20                                                 
CONECT   20   19   23   23   21                                       
CONECT   20   21   22                                                 
CONECT   21   20   20                                                 
CONECT   22   20   39                                                 
CONECT   23   20   20                                                 
CONECT   24    9   12   25   40                                       
CONECT   25   24   26   27   41                                       
CONECT   26   13   25                                                 
CONECT   27    2    5   25                                            
CONECT   28    3    5    5                                            
CONECT   29    4   42   43                                            
CONECT   30    1    1    2                                            
CONECT   31    1                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   18                                                      
CONECT   39   22                                                      
CONECT   40   24                                                      
CONECT   41   25                                                      
CONECT   42   29                                                      
CONECT   43   29                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
