COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       8.560  -0.096  -1.127  1.00  0.00           O  
HETATM    2  P   UNL     1       7.793  -1.412  -0.584  1.00  0.00           P  
HETATM    3  O   UNL     1       8.576  -2.262   0.374  1.00  0.00           O  
HETATM    4  O   UNL     1       7.332  -2.161  -1.942  1.00  0.00           O  
HETATM    5  O   UNL     1       6.399  -0.834  -0.007  1.00  0.00           O  
HETATM    6  C   UNL     1       5.601  -0.020  -0.859  1.00  0.00           C  
HETATM    7  C   UNL     1       4.309   0.441  -0.140  1.00  0.00           C  
HETATM    8  C   UNL     1       3.488  -0.809   0.258  1.00  0.00           C  
HETATM    9  C   UNL     1       4.674   1.187   1.159  1.00  0.00           C  
HETATM   10  C   UNL     1       3.435   1.332  -1.071  1.00  0.00           C  
HETATM   11  O   UNL     1       3.084   0.605  -2.245  1.00  0.00           O  
HETATM   12  C   UNL     1       4.125   2.610  -1.544  1.00  0.00           C  
HETATM   13  O   UNL     1       4.840   2.639  -2.544  1.00  0.00           O  
HETATM   14  N   UNL     1       3.834   3.704  -0.745  1.00  0.00           N  
HETATM   15  C   UNL     1       4.349   5.028  -1.005  1.00  0.00           C  
HETATM   16  C   UNL     1       5.679   5.214  -0.288  1.00  0.00           C  
HETATM   17  C   UNL     1       5.559   5.038   1.215  1.00  0.00           C  
HETATM   18  O   UNL     1       4.499   4.776   1.778  1.00  0.00           O  
HETATM   19  N   UNL     1       6.780   5.211   1.849  1.00  0.00           N  
HETATM   20  C   UNL     1       6.944   5.100   3.280  1.00  0.00           C  
HETATM   21  C   UNL     1       7.277   3.685   3.733  1.00  0.00           C  
HETATM   22  S   UNL     1       8.802   3.058   2.964  1.00  0.00           S  
HETATM   23  C   UNL     1       8.831   1.421   3.625  1.00  0.00           C  
HETATM   24  O   UNL     1       7.971   0.992   4.383  1.00  0.00           O  
HETATM   25  C   UNL     1      10.028   0.620   3.151  1.00  0.00           C  
HETATM   26  C   UNL     1      10.050  -0.785   3.750  1.00  0.00           C  
HETATM   27  C   UNL     1      11.235  -1.589   3.242  1.00  0.00           C  
HETATM   28  H   UNL     1       9.474  -0.188  -1.472  1.00  0.00           H  
HETATM   29  H   UNL     1       7.994  -2.682  -2.444  1.00  0.00           H  
HETATM   30  H   UNL     1       6.211   0.839  -1.157  1.00  0.00           H  
HETATM   31  H   UNL     1       5.367  -0.603  -1.756  1.00  0.00           H  
HETATM   32  H   UNL     1       2.538  -0.522   0.723  1.00  0.00           H  
HETATM   33  H   UNL     1       4.027  -1.436   0.977  1.00  0.00           H  
HETATM   34  H   UNL     1       3.259  -1.434  -0.613  1.00  0.00           H  
HETATM   35  H   UNL     1       5.163   0.523   1.880  1.00  0.00           H  
HETATM   36  H   UNL     1       3.779   1.592   1.644  1.00  0.00           H  
HETATM   37  H   UNL     1       5.362   2.017   0.967  1.00  0.00           H  
HETATM   38  H   UNL     1       2.499   1.595  -0.562  1.00  0.00           H  
HETATM   39  H   UNL     1       3.634   0.957  -2.963  1.00  0.00           H  
HETATM   40  H   UNL     1       3.210   3.591   0.048  1.00  0.00           H  
HETATM   41  H   UNL     1       4.472   5.162  -2.085  1.00  0.00           H  
HETATM   42  H   UNL     1       3.622   5.773  -0.666  1.00  0.00           H  
HETATM   43  H   UNL     1       6.077   6.217  -0.487  1.00  0.00           H  
HETATM   44  H   UNL     1       6.413   4.490  -0.663  1.00  0.00           H  
HETATM   45  H   UNL     1       7.596   5.426   1.282  1.00  0.00           H  
HETATM   46  H   UNL     1       7.765   5.771   3.553  1.00  0.00           H  
HETATM   47  H   UNL     1       6.032   5.477   3.755  1.00  0.00           H  
HETATM   48  H   UNL     1       7.393   3.640   4.820  1.00  0.00           H  
HETATM   49  H   UNL     1       6.463   3.010   3.451  1.00  0.00           H  
HETATM   50  H   UNL     1       9.990   0.551   2.057  1.00  0.00           H  
HETATM   51  H   UNL     1      10.942   1.154   3.438  1.00  0.00           H  
HETATM   52  H   UNL     1      10.096  -0.724   4.844  1.00  0.00           H  
HETATM   53  H   UNL     1       9.121  -1.312   3.501  1.00  0.00           H  
HETATM   54  H   UNL     1      11.229  -2.591   3.682  1.00  0.00           H  
HETATM   55  H   UNL     1      11.198  -1.697   2.153  1.00  0.00           H  
HETATM   56  H   UNL     1      12.180  -1.106   3.509  1.00  0.00           H  
CONECT    1    2   28                                                 
CONECT    2    1    3    3    4                                       
CONECT    2    5                                                      
CONECT    3    2    2                                                 
CONECT    4    2   29                                                 
CONECT    5    2    6                                                 
CONECT    6    5    7   30   31                                       
CONECT    7    6    8    9   10                                       
CONECT    8    7   32   33   34                                       
CONECT    9    7   35   36   37                                       
CONECT   10    7   11   12   38                                       
CONECT   11   10   39                                                 
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   40                                            
CONECT   15   14   16   41   42                                       
CONECT   16   15   17   43   44                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   45                                            
CONECT   20   19   21   46   47                                       
CONECT   21   20   22   48   49                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   50   51                                       
CONECT   26   25   27   52   53                                       
CONECT   27   26   54   55   56                                       
CONECT   28    1                                                      
CONECT   29    4                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
