COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.793   1.460   0.705  1.00  0.00           O  
HETATM    2  C   UNL     1       4.449   1.585   0.552  1.00  0.00           C  
HETATM    3  C   UNL     1       3.906   2.812   0.183  1.00  0.00           C  
HETATM    4  C   UNL     1       2.545   2.948   0.025  1.00  0.00           C  
HETATM    5  C   UNL     1       1.709   1.852   0.236  1.00  0.00           C  
HETATM    6  C   UNL     1       2.253   0.612   0.608  1.00  0.00           C  
HETATM    7  N   UNL     1       1.217  -0.293   0.751  1.00  0.00           N  
HETATM    8  C   UNL     1       3.629   0.490   0.763  1.00  0.00           C  
HETATM    9  C   UNL     1       0.251   1.662   0.156  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.813   2.515  -0.162  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.914   3.937  -0.531  1.00  0.00           C  
HETATM   12  O   UNL     1       0.018   4.709  -0.644  1.00  0.00           O  
HETATM   13  N   UNL     1      -2.211   4.239  -0.725  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.132   2.024  -0.150  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.991   3.162  -0.519  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.201   3.133  -0.620  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.373   0.682   0.172  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.598  -0.128   0.270  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.192  -1.422   0.637  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.815  -1.427   0.761  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.304  -0.173   0.486  1.00  0.00           C  
HETATM   22  C   UNL     1       0.007   0.317   0.478  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.951   0.151   0.077  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.882  -0.834   0.245  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.489  -2.119   0.608  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.151  -2.414   0.804  1.00  0.00           C  
HETATM   27  O   UNL     1      -6.425  -3.090   0.773  1.00  0.00           O  
HETATM   28  C   UNL     1       1.380  -1.698   1.131  1.00  0.00           C  
HETATM   29  C   UNL     1       2.871  -2.034   1.207  1.00  0.00           C  
HETATM   30  O   UNL     1       3.494  -1.219   2.202  1.00  0.00           O  
HETATM   31  C   UNL     1       3.515  -1.764  -0.157  1.00  0.00           C  
HETATM   32  O   UNL     1       4.872  -2.211  -0.145  1.00  0.00           O  
HETATM   33  C   UNL     1       2.728  -2.527  -1.229  1.00  0.00           C  
HETATM   34  O   UNL     1       3.218  -2.173  -2.524  1.00  0.00           O  
HETATM   35  C   UNL     1       1.248  -2.152  -1.122  1.00  0.00           C  
HETATM   36  C   UNL     1       0.459  -2.882  -2.211  1.00  0.00           C  
HETATM   37  O   UNL     1      -0.901  -2.443  -2.189  1.00  0.00           O  
HETATM   38  O   UNL     1       0.747  -2.529   0.159  1.00  0.00           O  
HETATM   39  H   UNL     1       6.150   1.202  -0.156  1.00  0.00           H  
HETATM   40  H   UNL     1       4.555   3.660   0.021  1.00  0.00           H  
HETATM   41  H   UNL     1       2.126   3.902  -0.260  1.00  0.00           H  
HETATM   42  H   UNL     1       4.059  -0.459   1.049  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.540   5.115  -0.979  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.284  -2.201   1.006  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.262   1.146  -0.206  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.929  -0.615   0.095  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.853  -3.413   1.085  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.698  -3.061   1.700  1.00  0.00           H  
HETATM   49  H   UNL     1       0.920  -1.866   2.105  1.00  0.00           H  
HETATM   50  H   UNL     1       2.995  -3.086   1.467  1.00  0.00           H  
HETATM   51  H   UNL     1       4.398  -1.547   2.306  1.00  0.00           H  
HETATM   52  H   UNL     1       3.484  -0.695  -0.371  1.00  0.00           H  
HETATM   53  H   UNL     1       5.236  -2.022  -1.020  1.00  0.00           H  
HETATM   54  H   UNL     1       2.846  -3.599  -1.074  1.00  0.00           H  
HETATM   55  H   UNL     1       4.153  -2.419  -2.546  1.00  0.00           H  
HETATM   56  H   UNL     1       1.136  -1.076  -1.253  1.00  0.00           H  
HETATM   57  H   UNL     1       0.497  -3.956  -2.030  1.00  0.00           H  
HETATM   58  H   UNL     1       0.896  -2.662  -3.185  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.362  -2.926  -2.889  1.00  0.00           H  
CONECT    1    2   39                                                 
CONECT    2    1    3    3    8                                       
CONECT    3    2    2    4   40                                       
CONECT    4    3    5    5   41                                       
CONECT    5    4    4    6    9                                       
CONECT    6    5    7    8    8                                       
CONECT    7    6   22   28                                            
CONECT    8    2    6    6   42                                       
CONECT    9    5   10   10   22                                       
CONECT   10    9    9   11   14                                       
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   15   43                                            
CONECT   14   10   15   17   17                                       
CONECT   15   13   14   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   14   14   18   21                                       
CONECT   18   17   19   19   23                                       
CONECT   19   18   18   20   26                                       
CONECT   20   19   21   44                                            
CONECT   21   17   20   22   22                                       
CONECT   22    7    9   21   21                                       
CONECT   23   18   24   24   45                                       
CONECT   24   23   23   25   46                                       
CONECT   25   24   26   26   27                                       
CONECT   26   19   25   25   47                                       
CONECT   27   25   48                                                 
CONECT   28    7   29   38   49                                       
CONECT   29   28   30   31   50                                       
CONECT   30   29   51                                                 
CONECT   31   29   32   33   52                                       
CONECT   32   31   53                                                 
CONECT   33   31   34   35   54                                       
CONECT   34   33   55                                                 
CONECT   35   33   36   38   56                                       
CONECT   36   35   37   57   58                                       
CONECT   37   36   59                                                 
CONECT   38   28   35                                                 
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    8                                                      
CONECT   43   13                                                      
CONECT   44   20                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
CONECT   55   34                                                      
CONECT   56   35                                                      
CONECT   57   36                                                      
CONECT   58   36                                                      
CONECT   59   37                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
