COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.882  -0.421   1.091  1.00  0.00           O  
HETATM    2  P   UNL     1      -4.124   0.010  -0.304  1.00  0.00           P  
HETATM    3  O   UNL     1      -4.358   1.603  -0.340  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.430  -0.737  -0.877  1.00  0.00           O  
HETATM    5  P   UNL     1      -6.556  -0.652   0.270  1.00  0.00           P  
HETATM    6  O   UNL     1      -7.251   0.799   0.235  1.00  0.00           O  
HETATM    7  O   UNL     1      -7.669  -1.787   0.014  1.00  0.00           O  
HETATM    8  O   UNL     1      -5.929  -0.867   1.594  1.00  0.00           O  
HETATM    9  O   UNL     1      -2.849  -0.366  -1.212  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.708   0.228  -0.588  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.455  -0.093  -1.405  1.00  0.00           C  
HETATM   12  C   UNL     1       0.747   0.532  -0.747  1.00  0.00           C  
HETATM   13  S   UNL     1       1.375   2.194  -0.918  1.00  0.00           S  
HETATM   14  C   UNL     1       2.773   2.048   0.185  1.00  0.00           C  
HETATM   15  C   UNL     1       3.688   2.961   0.518  1.00  0.00           C  
HETATM   16  C   UNL     1       3.718   4.291  -0.191  1.00  0.00           C  
HETATM   17  O   UNL     1       4.597   2.691   1.500  1.00  0.00           O  
HETATM   18  N   UNL     1       2.654   0.715   0.602  1.00  0.00           N  
HETATM   19  C   UNL     1       1.606  -0.015   0.108  1.00  0.00           C  
HETATM   20  C   UNL     1       1.431  -1.451   0.530  1.00  0.00           C  
HETATM   21  C   UNL     1       3.610   0.128   1.544  1.00  0.00           C  
HETATM   22  C   UNL     1       4.428  -0.923   0.839  1.00  0.00           C  
HETATM   23  C   UNL     1       5.285  -0.579  -0.209  1.00  0.00           C  
HETATM   24  N   UNL     1       5.402   0.739  -0.618  1.00  0.00           N  
HETATM   25  N   UNL     1       5.993  -1.536  -0.801  1.00  0.00           N  
HETATM   26  C   UNL     1       5.884  -2.791  -0.414  1.00  0.00           C  
HETATM   27  C   UNL     1       6.700  -3.847  -1.114  1.00  0.00           C  
HETATM   28  N   UNL     1       5.081  -3.148   0.568  1.00  0.00           N  
HETATM   29  C   UNL     1       4.346  -2.251   1.210  1.00  0.00           C  
HETATM   30  H   UNL     1      -4.512   1.842  -1.264  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.647   0.898  -0.642  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.323  -1.702   0.722  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.597  -0.172   0.420  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.843   1.308  -0.538  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.567   0.306  -2.413  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.321  -1.174  -1.455  1.00  0.00           H  
HETATM   37  H   UNL     1       4.527   4.900   0.213  1.00  0.00           H  
HETATM   38  H   UNL     1       3.881   4.132  -1.257  1.00  0.00           H  
HETATM   39  H   UNL     1       2.768   4.804  -0.041  1.00  0.00           H  
HETATM   40  H   UNL     1       4.523   3.400   2.152  1.00  0.00           H  
HETATM   41  H   UNL     1       0.534  -1.860   0.064  1.00  0.00           H  
HETATM   42  H   UNL     1       2.299  -2.031   0.217  1.00  0.00           H  
HETATM   43  H   UNL     1       1.332  -1.502   1.614  1.00  0.00           H  
HETATM   44  H   UNL     1       4.270   0.908   1.925  1.00  0.00           H  
HETATM   45  H   UNL     1       3.069  -0.328   2.373  1.00  0.00           H  
HETATM   46  H   UNL     1       5.967   0.964  -1.374  1.00  0.00           H  
HETATM   47  H   UNL     1       4.919   1.438  -0.149  1.00  0.00           H  
HETATM   48  H   UNL     1       6.134  -4.243  -1.958  1.00  0.00           H  
HETATM   49  H   UNL     1       7.630  -3.408  -1.475  1.00  0.00           H  
HETATM   50  H   UNL     1       6.925  -4.654  -0.417  1.00  0.00           H  
HETATM   51  H   UNL     1       3.692  -2.554   2.014  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    2    9                                                      
CONECT    3    2   30                                                 
CONECT    4    2    5                                                 
CONECT    5    4    6    7    8                                       
CONECT    5    8                                                      
CONECT    6    5   31                                                 
CONECT    7    5   32                                                 
CONECT    8    5    5                                                 
CONECT    9    2   10                                                 
CONECT   10    9   11   33   34                                       
CONECT   11   10   12   35   36                                       
CONECT   12   11   13   19   19                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   15   18                                       
CONECT   15   14   14   16   17                                       
CONECT   16   15   37   38   39                                       
CONECT   17   15   40                                                 
CONECT   18   14   19   21                                            
CONECT   19   12   12   18   20                                       
CONECT   20   19   41   42   43                                       
CONECT   21   18   22   44   45                                       
CONECT   22   21   23   23   29                                       
CONECT   23   22   22   24   25                                       
CONECT   24   23   46   47                                            
CONECT   25   23   26   26                                            
CONECT   26   25   25   27   28                                       
CONECT   27   26   48   49   50                                       
CONECT   28   26   29   29                                            
CONECT   29   22   28   28   51                                       
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   29                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
