COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       8.409  -1.186   1.125  1.00  0.00           N  
HETATM    2  C   UNL     1       8.092   0.138   1.059  1.00  0.00           C  
HETATM    3  N   UNL     1       9.062   1.070   1.331  1.00  0.00           N  
HETATM    4  N   UNL     1       6.886   0.548   0.736  1.00  0.00           N  
HETATM    5  C   UNL     1       5.909  -0.324   0.462  1.00  0.00           C  
HETATM    6  C   UNL     1       6.170  -1.698   0.518  1.00  0.00           C  
HETATM    7  C   UNL     1       7.473  -2.125   0.867  1.00  0.00           C  
HETATM    8  O   UNL     1       7.745  -3.312   0.929  1.00  0.00           O  
HETATM    9  N   UNL     1       5.020  -2.339   0.200  1.00  0.00           N  
HETATM   10  C   UNL     1       4.091  -1.462  -0.043  1.00  0.00           C  
HETATM   11  N   UNL     1       4.593  -0.202   0.106  1.00  0.00           N  
HETATM   12  C   UNL     1       3.858   1.052  -0.080  1.00  0.00           C  
HETATM   13  C   UNL     1       4.039   1.572  -1.523  1.00  0.00           C  
HETATM   14  O   UNL     1       5.050   2.580  -1.576  1.00  0.00           O  
HETATM   15  C   UNL     1       2.658   2.170  -1.880  1.00  0.00           C  
HETATM   16  O   UNL     1       2.774   3.566  -2.161  1.00  0.00           O  
HETATM   17  C   UNL     1       1.810   1.943  -0.609  1.00  0.00           C  
HETATM   18  O   UNL     1       2.439   0.827   0.060  1.00  0.00           O  
HETATM   19  C   UNL     1       0.368   1.596  -0.983  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.407   1.433   0.207  1.00  0.00           O  
HETATM   21  P   UNL     1      -1.905   1.071  -0.259  1.00  0.00           P  
HETATM   22  O   UNL     1      -2.398   2.113  -1.187  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.905  -0.355  -1.005  1.00  0.00           O  
HETATM   24  O   UNL     1      -8.829   1.076   1.044  1.00  0.00           O  
HETATM   25  C   UNL     1      -7.617   1.705   0.622  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.443   1.139   1.423  1.00  0.00           C  
HETATM   27  O   UNL     1      -6.235  -0.242   1.082  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.150   1.898   1.066  1.00  0.00           C  
HETATM   29  O   UNL     1      -4.601   2.530   2.224  1.00  0.00           O  
HETATM   30  C   UNL     1      -4.195   0.797   0.545  1.00  0.00           C  
HETATM   31  O   UNL     1      -2.866   1.003   1.031  1.00  0.00           O  
HETATM   32  C   UNL     1      -4.814  -0.487   1.155  1.00  0.00           C  
HETATM   33  N   UNL     1      -4.451  -1.666   0.365  1.00  0.00           N  
HETATM   34  C   UNL     1      -4.823  -1.746  -0.926  1.00  0.00           C  
HETATM   35  O   UNL     1      -5.455  -0.831  -1.427  1.00  0.00           O  
HETATM   36  N   UNL     1      -4.502  -2.804  -1.669  1.00  0.00           N  
HETATM   37  C   UNL     1      -3.815  -3.813  -1.149  1.00  0.00           C  
HETATM   38  C   UNL     1      -3.416  -3.762   0.202  1.00  0.00           C  
HETATM   39  C   UNL     1      -3.745  -2.678   0.943  1.00  0.00           C  
HETATM   40  N   UNL     1      -3.494  -4.903  -1.925  1.00  0.00           N  
HETATM   41  H   UNL     1       9.309  -1.455   1.366  1.00  0.00           H  
HETATM   42  H   UNL     1       8.853   2.016   1.284  1.00  0.00           H  
HETATM   43  H   UNL     1       9.956   0.783   1.575  1.00  0.00           H  
HETATM   44  H   UNL     1       3.073  -1.696  -0.321  1.00  0.00           H  
HETATM   45  H   UNL     1       4.197   1.799   0.638  1.00  0.00           H  
HETATM   46  H   UNL     1       4.285   0.750  -2.196  1.00  0.00           H  
HETATM   47  H   UNL     1       5.072   2.906  -2.486  1.00  0.00           H  
HETATM   48  H   UNL     1       2.221   1.645  -2.729  1.00  0.00           H  
HETATM   49  H   UNL     1       3.311   3.646  -2.962  1.00  0.00           H  
HETATM   50  H   UNL     1       1.834   2.828   0.027  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.055   2.400  -1.585  1.00  0.00           H  
HETATM   52  H   UNL     1       0.354   0.668  -1.555  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.578  -1.004  -0.367  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.542   1.460   0.516  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.688   2.780   0.792  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.459   1.514  -0.439  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.643   1.231   2.490  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.344   2.635   0.286  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.237   3.203   2.503  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.207   0.754  -0.544  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.499  -0.609   2.192  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.856  -4.576   0.639  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.450  -2.615   1.980  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.991  -5.639  -1.543  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.770  -4.935  -2.854  1.00  0.00           H  
CONECT    1    2    7   41                                            
CONECT    2    1    3    4    4                                       
CONECT    3    2   42   43                                            
CONECT    4    2    2    5                                            
CONECT    5    4    6    6   11                                       
CONECT    6    5    5    7    9                                       
CONECT    7    1    6    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    6   10   10                                            
CONECT   10    9    9   11   44                                       
CONECT   11    5   10   12                                            
CONECT   12   11   13   18   45                                       
CONECT   13   12   14   15   46                                       
CONECT   14   13   47                                                 
CONECT   15   13   16   17   48                                       
CONECT   16   15   49                                                 
CONECT   17   15   18   19   50                                       
CONECT   18   12   17                                                 
CONECT   19   17   20   51   52                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   22   23                                       
CONECT   21   31                                                      
CONECT   22   21   21                                                 
CONECT   23   21   53                                                 
CONECT   24   25   54                                                 
CONECT   25   24   26   55   56                                       
CONECT   26   25   27   28   57                                       
CONECT   27   26   32                                                 
CONECT   28   26   29   30   58                                       
CONECT   29   28   59                                                 
CONECT   30   28   31   32   60                                       
CONECT   31   21   30                                                 
CONECT   32   27   30   33   61                                       
CONECT   33   32   34   39                                            
CONECT   34   33   35   35   36                                       
CONECT   35   34   34                                                 
CONECT   36   34   37   37                                            
CONECT   37   36   36   38   40                                       
CONECT   38   37   39   39   62                                       
CONECT   39   33   38   38   63                                       
CONECT   40   37   64   65                                            
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   32                                                      
CONECT   62   38                                                      
CONECT   63   39                                                      
CONECT   64   40                                                      
CONECT   65   40                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
