COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.273  -2.346  -0.645  1.00  0.00           N  
HETATM    2  C   UNL     1       2.884  -3.485  -0.297  1.00  0.00           C  
HETATM    3  O   UNL     1       2.338  -4.545  -0.538  1.00  0.00           O  
HETATM    4  N   UNL     1       4.082  -3.491   0.310  1.00  0.00           N  
HETATM    5  C   UNL     1       4.800  -2.360   0.436  1.00  0.00           C  
HETATM    6  O   UNL     1       5.855  -2.381   1.033  1.00  0.00           O  
HETATM    7  C   UNL     1       4.307  -1.075  -0.153  1.00  0.00           C  
HETATM    8  N   UNL     1       4.464   0.045   0.782  1.00  0.00           N  
HETATM    9  C   UNL     1       3.820   1.245   0.438  1.00  0.00           C  
HETATM   10  C   UNL     1       4.318   2.465   0.860  1.00  0.00           C  
HETATM   11  C   UNL     1       3.672   3.633   0.495  1.00  0.00           C  
HETATM   12  C   UNL     1       4.211   4.964   0.953  1.00  0.00           C  
HETATM   13  C   UNL     1       2.534   3.582  -0.289  1.00  0.00           C  
HETATM   14  C   UNL     1       1.842   4.859  -0.689  1.00  0.00           C  
HETATM   15  C   UNL     1       2.029   2.366  -0.710  1.00  0.00           C  
HETATM   16  C   UNL     1       2.663   1.189  -0.343  1.00  0.00           C  
HETATM   17  N   UNL     1       2.138  -0.049  -0.731  1.00  0.00           N  
HETATM   18  C   UNL     1       2.859  -1.182  -0.545  1.00  0.00           C  
HETATM   19  C   UNL     1       0.808  -0.121  -1.341  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.255  -0.163  -0.241  1.00  0.00           C  
HETATM   21  O   UNL     1      -0.122  -1.375   0.504  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.646  -0.105  -0.875  1.00  0.00           C  
HETATM   23  O   UNL     1      -1.780   1.107  -1.620  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.710  -0.147   0.225  1.00  0.00           C  
HETATM   25  O   UNL     1      -2.576  -1.359   0.970  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.101  -0.089  -0.408  1.00  0.00           C  
HETATM   27  O   UNL     1      -5.090  -0.011   0.620  1.00  0.00           O  
HETATM   28  P   UNL     1      -6.669   0.066   0.315  1.00  0.00           P  
HETATM   29  O   UNL     1      -6.941   1.203  -0.592  1.00  0.00           O  
HETATM   30  O   UNL     1      -7.148  -1.304  -0.383  1.00  0.00           O  
HETATM   31  O   UNL     1      -7.473   0.275   1.694  1.00  0.00           O  
HETATM   32  H   UNL     1       4.436  -4.323   0.662  1.00  0.00           H  
HETATM   33  H   UNL     1       4.894  -0.852  -1.044  1.00  0.00           H  
HETATM   34  H   UNL     1       4.985  -0.039   1.596  1.00  0.00           H  
HETATM   35  H   UNL     1       5.207   2.505   1.472  1.00  0.00           H  
HETATM   36  H   UNL     1       4.921   5.341   0.217  1.00  0.00           H  
HETATM   37  H   UNL     1       3.388   5.671   1.060  1.00  0.00           H  
HETATM   38  H   UNL     1       4.712   4.842   1.913  1.00  0.00           H  
HETATM   39  H   UNL     1       2.256   5.218  -1.631  1.00  0.00           H  
HETATM   40  H   UNL     1       0.775   4.672  -0.809  1.00  0.00           H  
HETATM   41  H   UNL     1       1.994   5.612   0.085  1.00  0.00           H  
HETATM   42  H   UNL     1       1.140   2.333  -1.323  1.00  0.00           H  
HETATM   43  H   UNL     1       0.648   0.757  -1.967  1.00  0.00           H  
HETATM   44  H   UNL     1       0.736  -1.021  -1.951  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.123   0.689   0.425  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.210  -2.177  -0.030  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.779  -0.957  -1.541  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.674   1.909  -1.089  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.578   0.705   0.891  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.682  -2.161   0.439  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.172   0.791  -1.048  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.267  -0.986  -1.005  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.999  -2.093   0.156  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.432   0.330   1.586  1.00  0.00           H  
CONECT    1   18   18    2                                            
CONECT    2    4    1    3    3                                       
CONECT    3    2    2                                                 
CONECT    4    5    2   32                                            
CONECT    5    6    6    7    4                                       
CONECT    6    5    5                                                 
CONECT    7    8    5   18   33                                       
CONECT    8    9    7   34                                            
CONECT    9   10    8   16   16                                       
CONECT   10   11   11    9   35                                       
CONECT   11   12   10   10   13                                       
CONECT   12   11   36   37   38                                       
CONECT   13   11   14   15   15                                       
CONECT   14   13   39   40   41                                       
CONECT   15   13   13   16   42                                       
CONECT   16    9    9   15   17                                       
CONECT   17   16   18   19                                            
CONECT   18    7   17    1    1                                       
CONECT   19   17   20   43   44                                       
CONECT   20   21   19   22   45                                       
CONECT   21   20   46                                                 
CONECT   22   20   23   24   47                                       
CONECT   23   22   48                                                 
CONECT   24   22   25   26   49                                       
CONECT   25   24   50                                                 
CONECT   26   24   27   51   52                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   29   30                                       
CONECT   28   31                                                      
CONECT   29   28   28                                                 
CONECT   30   28   53                                                 
CONECT   31   28   54                                                 
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
