COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.348  -0.932   9.041  1.00  0.00           N  
HETATM    2  C   UNL     1       1.265  -1.622   8.731  1.00  0.00           C  
HETATM    3  N   UNL     1       0.592  -1.418   7.618  1.00  0.00           N  
HETATM    4  C   UNL     1       0.984  -0.493   6.749  1.00  0.00           C  
HETATM    5  C   UNL     1       2.128   0.271   7.035  1.00  0.00           C  
HETATM    6  C   UNL     1       2.816   0.012   8.233  1.00  0.00           C  
HETATM    7  N   UNL     1       3.952   0.730   8.566  1.00  0.00           N  
HETATM    8  N   UNL     1       2.307   1.124   5.999  1.00  0.00           N  
HETATM    9  C   UNL     1       1.365   0.943   5.120  1.00  0.00           C  
HETATM   10  N   UNL     1       0.523  -0.044   5.537  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.656  -0.537   4.822  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.902   0.290   5.207  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.672  -0.385   6.202  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.700   0.400   3.886  1.00  0.00           C  
HETATM   15  O   UNL     1      -3.986  -0.206   4.025  1.00  0.00           O  
HETATM   16  O   UNL     1      -0.502  -0.338   3.400  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.842  -0.377   2.863  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.888   0.307   1.496  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.032  -0.386   0.586  1.00  0.00           O  
HETATM   20  P   UNL     1      -1.129   0.384  -0.823  1.00  0.00           P  
HETATM   21  O   UNL     1      -0.686   1.786  -0.651  1.00  0.00           O  
HETATM   22  O   UNL     1      -2.652   0.362  -1.343  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.183  -0.348  -1.901  1.00  0.00           O  
HETATM   24  P   UNL     1      -0.328   0.470  -3.280  1.00  0.00           P  
HETATM   25  O   UNL     1       0.101   1.871  -3.069  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.865   0.447  -3.758  1.00  0.00           O  
HETATM   27  O   UNL     1       0.595  -0.210  -4.408  1.00  0.00           O  
HETATM   28  C   UNL     1       0.423   0.556  -5.601  1.00  0.00           C  
HETATM   29  O   UNL     1       0.853  -1.385  -6.996  1.00  0.00           O  
HETATM   30  O   UNL     1       0.208  -2.680  -8.863  1.00  0.00           O  
HETATM   31  C   UNL     1       1.030  -1.602  -8.412  1.00  0.00           C  
HETATM   32  O   UNL     1       1.185  -0.064 -10.319  1.00  0.00           O  
HETATM   33  C   UNL     1       0.574  -0.261  -9.042  1.00  0.00           C  
HETATM   34  O   UNL     1       2.341   1.326  -8.446  1.00  0.00           O  
HETATM   35  C   UNL     1       1.096   0.775  -8.014  1.00  0.00           C  
HETATM   36  C   UNL     1       1.279  -0.041  -6.720  1.00  0.00           C  
HETATM   37  H   UNL     1       0.918  -2.381   9.417  1.00  0.00           H  
HETATM   38  H   UNL     1       4.416   0.544   9.397  1.00  0.00           H  
HETATM   39  H   UNL     1       4.286   1.415   7.966  1.00  0.00           H  
HETATM   40  H   UNL     1       1.265   1.493   4.196  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.819  -1.592   5.042  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.608   1.279   5.559  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.464   0.149   6.354  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.801   1.443   3.585  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.474   0.319   4.673  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.189  -1.407   2.782  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.910   0.293   1.116  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.552   1.340   1.595  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.901  -0.566  -1.442  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.105  -0.480  -3.884  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.625   0.539  -5.897  1.00  0.00           H  
HETATM   52  H   UNL     1       0.732   1.586  -5.418  1.00  0.00           H  
HETATM   53  H   UNL     1       0.495  -3.469  -8.385  1.00  0.00           H  
HETATM   54  H   UNL     1       2.078  -1.797  -8.642  1.00  0.00           H  
HETATM   55  H   UNL     1       0.892  -0.792 -10.884  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.512  -0.219  -9.122  1.00  0.00           H  
HETATM   57  H   UNL     1       2.172   1.772  -9.288  1.00  0.00           H  
HETATM   58  H   UNL     1       0.361   1.567  -7.864  1.00  0.00           H  
HETATM   59  H   UNL     1       2.329  -0.038  -6.425  1.00  0.00           H  
CONECT    1    2    6    6                                            
CONECT    2    1    3    3   37                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5    5   10                                       
CONECT    5    4    4    6    8                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6   38   39                                            
CONECT    8    5    9    9                                            
CONECT    9    8    8   10   40                                       
CONECT   10    4    9   11                                            
CONECT   11   10   12   16   41                                       
CONECT   12   11   13   14   42                                       
CONECT   13   12   43                                                 
CONECT   14   12   15   17   44                                       
CONECT   15   14   45                                                 
CONECT   16   11   17                                                 
CONECT   17   14   16   18   46                                       
CONECT   18   17   19   47   48                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   21   22                                       
CONECT   20   23                                                      
CONECT   21   20   20                                                 
CONECT   22   20   49                                                 
CONECT   23   20   24                                                 
CONECT   24   23   25   25   26                                       
CONECT   24   27                                                      
CONECT   25   24   24                                                 
CONECT   26   24   50                                                 
CONECT   27   24   28                                                 
CONECT   28   27   36   51   52                                       
CONECT   29   31   36                                                 
CONECT   30   31   53                                                 
CONECT   31   29   30   33   54                                       
CONECT   32   33   55                                                 
CONECT   33   31   32   35   56                                       
CONECT   34   35   57                                                 
CONECT   35   33   34   36   58                                       
CONECT   36   28   29   35   59                                       
CONECT   37    2                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   22                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   33                                                      
CONECT   57   34                                                      
CONECT   58   35                                                      
CONECT   59   36                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
