COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.025  -0.844  -1.876  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.274   0.061  -0.942  1.00  0.00           C  
HETATM    3  O   UNL     1       1.412  -0.719   3.401  1.00  0.00           O  
HETATM    4  O   UNL     1      -0.394  -0.420   5.287  1.00  0.00           O  
HETATM    5  O   UNL     1       0.432  -0.376   7.782  1.00  0.00           O  
HETATM    6  O   UNL     1       0.979   1.497   6.182  1.00  0.00           O  
HETATM    7  O   UNL     1       2.162  -0.703   5.830  1.00  0.00           O  
HETATM    8  P   UNL     1       0.798   0.031   6.269  1.00  0.00           P  
HETATM    9  P   UNL     1       0.035   0.015   3.799  1.00  0.00           P  
HETATM   10  O   UNL     1       0.228   1.482   3.751  1.00  0.00           O  
HETATM   11  O   UNL     1      -1.118  -0.408   2.760  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.679   0.002   1.464  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.737  -0.372   0.424  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.463  -2.272  -1.676  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.355  -0.474  -3.050  1.00  0.00           N  
HETATM   16  O   UNL     1      -2.968   0.280   0.740  1.00  0.00           O  
HETATM   17  S   UNL     1      -1.065   1.774  -1.298  1.00  0.00           S  
HETATM   18  C   UNL     1      -0.224  -1.432  -4.151  1.00  0.00           C  
HETATM   19  C   UNL     1       0.420  -0.754  -5.332  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.336   0.018  -6.215  1.00  0.00           C  
HETATM   21  N   UNL     1       0.272   0.604  -7.242  1.00  0.00           N  
HETATM   22  C   UNL     1       1.567   0.451  -7.432  1.00  0.00           C  
HETATM   23  N   UNL     1       2.308  -0.275  -6.621  1.00  0.00           N  
HETATM   24  C   UNL     1       1.774  -0.886  -5.572  1.00  0.00           C  
HETATM   25  N   UNL     1      -1.697   0.181  -6.018  1.00  0.00           N  
HETATM   26  C   UNL     1       2.218   1.126  -8.612  1.00  0.00           C  
HETATM   27  H   UNL     1       1.243  -1.670   3.445  1.00  0.00           H  
HETATM   28  H   UNL     1       1.171  -0.088   8.336  1.00  0.00           H  
HETATM   29  H   UNL     1       2.002  -1.654   5.900  1.00  0.00           H  
HETATM   30  H   UNL     1       0.259  -0.495   1.223  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.530   1.082   1.457  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.886  -1.452   0.431  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.002  -2.358  -0.733  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.115  -2.571  -2.496  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.587  -2.921  -1.654  1.00  0.00           H  
HETATM   36  H   UNL     1       0.021   0.414  -3.133  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.793   1.230   0.724  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.798   1.708  -2.615  1.00  0.00           H  
HETATM   39  H   UNL     1       0.394  -2.271  -3.832  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.211  -1.796  -4.436  1.00  0.00           H  
HETATM   41  H   UNL     1       2.390  -1.479  -4.913  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.215   0.726  -6.631  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.134  -0.248  -5.266  1.00  0.00           H  
HETATM   44  H   UNL     1       2.192   0.459  -9.473  1.00  0.00           H  
HETATM   45  H   UNL     1       1.681   2.045  -8.847  1.00  0.00           H  
HETATM   46  H   UNL     1       3.254   1.364  -8.368  1.00  0.00           H  
CONECT    1    2    2   14   15                                       
CONECT    2    1    1   13   17                                       
CONECT    3    9   27                                                 
CONECT    4    8    9                                                 
CONECT    5    8   28                                                 
CONECT    6    8    8                                                 
CONECT    7    8   29                                                 
CONECT    8    4    5    6    6                                       
CONECT    8    7                                                      
CONECT    9    3    4   10   10                                       
CONECT    9   11                                                      
CONECT   10    9    9                                                 
CONECT   11    9   12                                                 
CONECT   12   11   13   30   31                                       
CONECT   13    2   12   16   32                                       
CONECT   14    1   33   34   35                                       
CONECT   15    1   18   36                                            
CONECT   16   13   37                                                 
CONECT   17    2   38                                                 
CONECT   18   15   19   39   40                                       
CONECT   19   18   20   24   24                                       
CONECT   20   19   21   21   25                                       
CONECT   21   20   20   22                                            
CONECT   22   21   23   23   26                                       
CONECT   23   22   22   24                                            
CONECT   24   19   19   23   41                                       
CONECT   25   20   42   43                                            
CONECT   26   22   44   45   46                                       
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
