COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       5.849   6.093   0.650  1.00  0.00           S  
HETATM    2  O   UNL     1       6.154   7.570   0.031  1.00  0.00           O  
HETATM    3  O   UNL     1       6.809   5.859   1.712  1.00  0.00           O  
HETATM    4  O   UNL     1       4.424   6.018   0.912  1.00  0.00           O  
HETATM    5  O   UNL     1       6.196   5.104  -0.603  1.00  0.00           O  
HETATM    6  P   UNL     1       6.144   3.524  -0.251  1.00  0.00           P  
HETATM    7  O   UNL     1       7.086   3.052   0.820  1.00  0.00           O  
HETATM    8  O   UNL     1       6.381   2.827  -1.694  1.00  0.00           O  
HETATM    9  O   UNL     1       4.566   3.301   0.029  1.00  0.00           O  
HETATM   10  C   UNL     1       4.092   1.980   0.223  1.00  0.00           C  
HETATM   11  C   UNL     1       2.595   2.031   0.465  1.00  0.00           C  
HETATM   12  O   UNL     1       1.933   2.574  -0.689  1.00  0.00           O  
HETATM   13  C   UNL     1       0.622   1.976  -0.784  1.00  0.00           C  
HETATM   14  N   UNL     1       0.424   1.450  -2.136  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.749   1.408  -2.837  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.956   1.836  -2.437  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.875   1.627  -3.404  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.709   1.075  -4.630  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.462   0.665  -4.967  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.225   0.085  -6.225  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.426   0.827  -4.052  1.00  0.00           C  
HETATM   22  N   UNL     1       0.910   0.517  -4.103  1.00  0.00           N  
HETATM   23  C   UNL     1       1.390   0.903  -2.940  1.00  0.00           C  
HETATM   24  C   UNL     1       0.518   0.913   0.310  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.210   1.445   1.415  1.00  0.00           O  
HETATM   26  C   UNL     1       1.969   0.663   0.677  1.00  0.00           C  
HETATM   27  O   UNL     1       2.143   0.197   1.998  1.00  0.00           O  
HETATM   28  P   UNL     1       1.433  -1.191   2.415  1.00  0.00           P  
HETATM   29  O   UNL     1       2.004  -1.486   3.899  1.00  0.00           O  
HETATM   30  O   UNL     1       2.208  -2.273   1.496  1.00  0.00           O  
HETATM   31  O   UNL     1      -0.062  -1.207   2.288  1.00  0.00           O  
HETATM   32  H   UNL     1       5.775   7.739  -0.863  1.00  0.00           H  
HETATM   33  H   UNL     1       7.293   2.766  -2.048  1.00  0.00           H  
HETATM   34  H   UNL     1       4.308   1.388  -0.668  1.00  0.00           H  
HETATM   35  H   UNL     1       4.597   1.541   1.085  1.00  0.00           H  
HETATM   36  H   UNL     1       2.399   2.693   1.317  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.125   2.769  -0.673  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.885   1.945  -3.168  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.293  -0.186  -6.475  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.971   0.035  -6.893  1.00  0.00           H  
HETATM   41  H   UNL     1       2.421   0.814  -2.623  1.00  0.00           H  
HETATM   42  H   UNL     1       0.000   0.001  -0.003  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.922   0.815   1.623  1.00  0.00           H  
HETATM   44  H   UNL     1       2.403  -0.065  -0.019  1.00  0.00           H  
HETATM   45  H   UNL     1       1.661  -2.260   4.394  1.00  0.00           H  
HETATM   46  H   UNL     1       1.897  -3.203   1.494  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    4    5                                                 
CONECT    2    1   32                                                 
CONECT    3    1    1                                                 
CONECT    4    1    1                                                 
CONECT    5    1    6                                                 
CONECT    6    5    7    7    8                                       
CONECT    6    9                                                      
CONECT    7    6    6                                                 
CONECT    8    6   33                                                 
CONECT    9    6   10                                                 
CONECT   10    9   11   34   35                                       
CONECT   11   10   12   26   36                                       
CONECT   12   11   13                                                 
CONECT   13   12   14   24   37                                       
CONECT   14   13   15   23                                            
CONECT   15   14   16   21   21                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   38                                       
CONECT   18   17   19   19                                            
CONECT   19   18   18   20   21                                       
CONECT   20   19   39   40                                            
CONECT   21   15   15   19   22                                       
CONECT   22   21   23   23                                            
CONECT   23   14   22   22   41                                       
CONECT   24   13   25   26   42                                       
CONECT   25   24   43                                                 
CONECT   26   11   24   27   44                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   30   31                                       
CONECT   28   31                                                      
CONECT   29   28   45                                                 
CONECT   30   28   46                                                 
CONECT   31   28   28                                                 
CONECT   32    2                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   17                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   29                                                      
CONECT   46   30                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
