COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.911  -0.169  -0.055  1.00  0.00           C  
HETATM    2  C   UNL     1       0.137   0.662  -0.805  1.00  0.00           C  
HETATM    3  C   UNL     1       1.227   1.065   0.195  1.00  0.00           C  
HETATM    4  C   UNL     1       1.797  -0.186   0.852  1.00  0.00           C  
HETATM    5  C   UNL     1       2.618  -0.996  -0.148  1.00  0.00           C  
HETATM    6  C   UNL     1       0.241  -2.367  -0.429  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.230  -1.356   0.613  1.00  0.00           C  
HETATM    8  C   UNL     1       3.695  -0.125  -0.744  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.270  -2.044   1.459  1.00  0.00           C  
HETATM   10  C   UNL     1       0.643   3.258   1.035  1.00  0.00           C  
HETATM   11  C   UNL     1       0.049   4.155   2.092  1.00  0.00           C  
HETATM   12  O   UNL     1       0.806  -0.964   1.487  1.00  0.00           O  
HETATM   13  O   UNL     1       3.216  -2.111   0.515  1.00  0.00           O  
HETATM   14  O   UNL     1       3.777   0.000  -1.947  1.00  0.00           O  
HETATM   15  O   UNL     1      -2.431  -2.024   1.124  1.00  0.00           O  
HETATM   16  O   UNL     1      -0.907  -2.680   2.584  1.00  0.00           O  
HETATM   17  O   UNL     1      -1.895  -0.640  -0.978  1.00  0.00           O  
HETATM   18  O   UNL     1      -3.018   1.736  -1.034  1.00  0.00           O  
HETATM   19  O   UNL     1      -3.598   0.050   0.753  1.00  0.00           O  
HETATM   20  O   UNL     1      -4.443  -0.405  -1.581  1.00  0.00           O  
HETATM   21  O   UNL     1       0.655   1.928   1.213  1.00  0.00           O  
HETATM   22  O   UNL     1       1.108   3.738   0.028  1.00  0.00           O  
HETATM   23  N   UNL     1       4.566   0.514   0.061  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.491   1.865  -1.367  1.00  0.00           N  
HETATM   25  P   UNL     1      -3.246   0.182  -0.679  1.00  0.00           P  
HETATM   26  S   UNL     1       1.516  -1.590  -1.467  1.00  0.00           S  
HETATM   27  H   UNL     1      -1.391   0.450   0.703  1.00  0.00           H  
HETATM   28  H   UNL     1       0.574   0.067  -1.606  1.00  0.00           H  
HETATM   29  H   UNL     1       2.022   1.596  -0.327  1.00  0.00           H  
HETATM   30  H   UNL     1       2.482   0.146   1.632  1.00  0.00           H  
HETATM   31  H   UNL     1       0.660  -3.240   0.072  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.602  -2.670  -1.050  1.00  0.00           H  
HETATM   33  H   UNL     1       0.129   5.194   1.773  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.000   3.899   2.238  1.00  0.00           H  
HETATM   35  H   UNL     1       0.590   4.019   3.029  1.00  0.00           H  
HETATM   36  H   UNL     1       3.715  -2.599  -0.154  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.575  -3.121   3.127  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.792   1.778  -1.973  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.232   0.115  -1.372  1.00  0.00           H  
HETATM   40  H   UNL     1       4.549   0.355   1.018  1.00  0.00           H  
HETATM   41  H   UNL     1       5.211   1.133  -0.316  1.00  0.00           H  
HETATM   42  H   UNL     1       0.241   2.386  -1.827  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.122   1.553  -2.089  1.00  0.00           H  
CONECT    1    2    7   17   27                                       
CONECT    2    1    3   24   28                                       
CONECT    3    2    4   21   29                                       
CONECT    4    3    5   12   30                                       
CONECT    5    4    8   13   26                                       
CONECT    6    7   26   31   32                                       
CONECT    7    1    6    9   12                                       
CONECT    8    5   14   14   23                                       
CONECT    9    7   15   15   16                                       
CONECT   10   11   21   22   22                                       
CONECT   11   10   33   34   35                                       
CONECT   12    4    7                                                 
CONECT   13    5   36                                                 
CONECT   14    8    8                                                 
CONECT   15    9    9                                                 
CONECT   16    9   37                                                 
CONECT   17    1   25                                                 
CONECT   18   25   38                                                 
CONECT   19   25   25                                                 
CONECT   20   25   39                                                 
CONECT   21    3   10                                                 
CONECT   22   10   10                                                 
CONECT   23    8   40   41                                            
CONECT   24    2   42   43                                            
CONECT   25   17   18   19   19                                       
CONECT   25   20                                                      
CONECT   26    5    6                                                 
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
CONECT   39   20                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
