COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.615   3.121   0.709  1.00  0.00           C  
HETATM    2  C   UNL     1      11.429   1.611   0.549  1.00  0.00           C  
HETATM    3  C   UNL     1       9.937   1.287   0.457  1.00  0.00           C  
HETATM    4  C   UNL     1       9.752  -0.223   0.297  1.00  0.00           C  
HETATM    5  C   UNL     1       8.281  -0.542   0.206  1.00  0.00           C  
HETATM    6  C   UNL     1       7.657  -0.567  -1.028  1.00  0.00           C  
HETATM    7  C   UNL     1       6.311  -0.859  -1.117  1.00  0.00           C  
HETATM    8  C   UNL     1       7.563  -0.814   1.356  1.00  0.00           C  
HETATM    9  C   UNL     1       6.217  -1.107   1.279  1.00  0.00           C  
HETATM   10  C   UNL     1       5.581  -1.128   0.039  1.00  0.00           C  
HETATM   11  C   UNL     1       4.134  -1.443  -0.051  1.00  0.00           C  
HETATM   12  C   UNL     1       3.404  -1.712   1.105  1.00  0.00           C  
HETATM   13  C   UNL     1       2.058  -2.004   1.016  1.00  0.00           C  
HETATM   14  C   UNL     1       3.498  -1.464  -1.290  1.00  0.00           C  
HETATM   15  C   UNL     1       2.152  -1.757  -1.368  1.00  0.00           C  
HETATM   16  C   UNL     1       1.433  -2.030  -0.218  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.037  -2.349  -0.309  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.847  -1.055  -0.210  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.339  -1.379  -0.302  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.149  -0.085  -0.203  1.00  0.00           C  
HETATM   21  P   UNL     1      -4.928  -0.483  -0.164  1.00  0.00           P  
HETATM   22  O   UNL     1      -5.212  -1.556   1.003  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.772   0.858   0.123  1.00  0.00           O  
HETATM   24  O   UNL     1      -5.335  -1.053  -1.468  1.00  0.00           O  
HETATM   25  S   UNL     1      -2.796   0.961  -1.643  1.00  0.00           S  
HETATM   26  O   UNL     1      -1.504   1.542  -1.531  1.00  0.00           O  
HETATM   27  O   UNL     1      -3.208   0.318  -2.840  1.00  0.00           O  
HETATM   28  O   UNL     1      -3.750   2.138  -1.500  1.00  0.00           O  
HETATM   29  H   UNL     1      12.678   3.352   0.775  1.00  0.00           H  
HETATM   30  H   UNL     1      11.184   3.633  -0.151  1.00  0.00           H  
HETATM   31  H   UNL     1      11.114   3.454   1.618  1.00  0.00           H  
HETATM   32  H   UNL     1      11.930   1.278  -0.360  1.00  0.00           H  
HETATM   33  H   UNL     1      11.860   1.099   1.410  1.00  0.00           H  
HETATM   34  H   UNL     1       9.436   1.620   1.366  1.00  0.00           H  
HETATM   35  H   UNL     1       9.507   1.799  -0.404  1.00  0.00           H  
HETATM   36  H   UNL     1      10.252  -0.556  -0.612  1.00  0.00           H  
HETATM   37  H   UNL     1      10.182  -0.735   1.157  1.00  0.00           H  
HETATM   38  H   UNL     1       8.224  -0.358  -1.923  1.00  0.00           H  
HETATM   39  H   UNL     1       5.824  -0.878  -2.081  1.00  0.00           H  
HETATM   40  H   UNL     1       8.057  -0.797   2.317  1.00  0.00           H  
HETATM   41  H   UNL     1       5.656  -1.319   2.178  1.00  0.00           H  
HETATM   42  H   UNL     1       3.891  -1.693   2.069  1.00  0.00           H  
HETATM   43  H   UNL     1       1.491  -2.214   1.912  1.00  0.00           H  
HETATM   44  H   UNL     1       4.058  -1.251  -2.189  1.00  0.00           H  
HETATM   45  H   UNL     1       1.658  -1.774  -2.328  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.244  -2.836  -1.261  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.315  -3.015   0.508  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.639  -0.568   0.743  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.569  -0.389  -1.026  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.547  -1.866  -1.255  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.618  -2.045   0.515  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.876   0.446   0.708  1.00  0.00           H  
HETATM   53  K   UNL     1      -7.478  -2.187   1.195  1.00  0.00           K  
HETATM   54  K   UNL     1      -5.396   1.790   2.258  1.00  0.00           K  
HETATM   55  K   UNL     1      -3.141   3.670   0.189  1.00  0.00           K  
CONECT    1    2   29   30   31                                       
CONECT    2    1    3   32   33                                       
CONECT    3    2    4   34   35                                       
CONECT    4    3    5   36   37                                       
CONECT    5    4    6    6    8                                       
CONECT    6    5    5    7   38                                       
CONECT    7    6   10   10   39                                       
CONECT    8    5    9    9   40                                       
CONECT    9    8    8   10   41                                       
CONECT   10    7    7    9   11                                       
CONECT   11   10   12   12   14                                       
CONECT   12   11   11   13   42                                       
CONECT   13   12   16   16   43                                       
CONECT   14   11   15   15   44                                       
CONECT   15   14   14   16   45                                       
CONECT   16   13   13   15   17                                       
CONECT   17   16   18   46   47                                       
CONECT   18   17   19   48   49                                       
CONECT   19   18   20   50   51                                       
CONECT   20   19   25   21   52                                       
CONECT   21   24   24   22   23                                       
CONECT   21   20                                                      
CONECT   22   21   53                                                 
CONECT   23   21   54                                                 
CONECT   24   21   21                                                 
CONECT   25   20   26   26   27                                       
CONECT   25   27   28                                                 
CONECT   26   25   25                                                 
CONECT   27   25   25                                                 
CONECT   28   25   55                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   28                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
