COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.528   1.077   0.261  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.785   3.361  -0.109  1.00  0.00           N  
HETATM    3  O   UNL     1      -2.055   0.817  -0.825  1.00  0.00           O  
HETATM    4  P   UNL     1      -2.747  -1.481   0.615  1.00  0.00           P  
HETATM    5  N   UNL     1       7.326   1.176  -1.707  1.00  0.00           N  
HETATM    6  C   UNL     1       7.054  -0.116  -1.722  1.00  0.00           C  
HETATM    7  N   UNL     1       5.929  -0.607  -1.247  1.00  0.00           N  
HETATM    8  C   UNL     1       5.006   0.195  -0.726  1.00  0.00           C  
HETATM    9  C   UNL     1       5.247   1.579  -0.687  1.00  0.00           C  
HETATM   10  C   UNL     1       6.464   2.055  -1.206  1.00  0.00           C  
HETATM   11  N   UNL     1       6.757   3.407  -1.195  1.00  0.00           N  
HETATM   12  N   UNL     1       4.164   2.157  -0.115  1.00  0.00           N  
HETATM   13  C   UNL     1       3.295   1.238   0.192  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.915   0.082   1.083  1.00  0.00           N  
HETATM   15  N   UNL     1       3.768   0.011  -0.165  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.676   2.513   0.694  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.125   2.960   0.490  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.303   4.353   1.035  1.00  0.00           C  
HETATM   19  C   UNL     1       3.080  -1.270   0.017  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.242  -2.373   1.687  1.00  0.00           O  
HETATM   21  C   UNL     1       3.476  -1.906   1.368  1.00  0.00           C  
HETATM   22  O   UNL     1       4.493  -2.891   1.179  1.00  0.00           O  
HETATM   23  C   UNL     1       2.171  -2.563   1.870  1.00  0.00           C  
HETATM   24  O   UNL     1       2.342  -3.976   2.006  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.598  -1.733  -0.729  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.026  -1.746  -0.754  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.509  -2.011  -2.182  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.038  -2.025  -2.209  1.00  0.00           C  
HETATM   29  N   UNL     1      -7.501  -2.280  -3.580  1.00  0.00           N  
HETATM   30  C   UNL     1       1.141  -2.248   0.762  1.00  0.00           C  
HETATM   31  O   UNL     1       1.653  -1.066   0.108  1.00  0.00           O  
HETATM   32  C   UNL     1      -0.232  -1.967   1.375  1.00  0.00           C  
HETATM   33  O   UNL     1      -1.193  -1.793   0.332  1.00  0.00           O  
HETATM   34  O   UNL     1      -5.501   4.954   0.965  1.00  0.00           O  
HETATM   35  O   UNL     1      -3.367   4.930   1.536  1.00  0.00           O  
HETATM   36  H   UNL     1      -0.817   3.128   0.058  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.009   3.294  -1.090  1.00  0.00           H  
HETATM   38  H   UNL     1       7.783  -0.795  -2.139  1.00  0.00           H  
HETATM   39  H   UNL     1       7.600   3.724  -1.556  1.00  0.00           H  
HETATM   40  H   UNL     1       6.119   4.039  -0.826  1.00  0.00           H  
HETATM   41  H   UNL     1       2.339   1.422   0.661  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.293   0.290   1.952  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.413   2.604   1.747  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.361   2.953  -0.575  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.793   2.276   1.014  1.00  0.00           H  
HETATM   46  H   UNL     1       3.315  -1.946  -0.805  1.00  0.00           H  
HETATM   47  H   UNL     1       3.812  -1.139   2.067  1.00  0.00           H  
HETATM   48  H   UNL     1       4.779  -3.322   1.996  1.00  0.00           H  
HETATM   49  H   UNL     1       1.860  -2.122   2.817  1.00  0.00           H  
HETATM   50  H   UNL     1       3.021  -4.229   2.646  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.395  -2.531  -0.094  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.404  -0.781  -0.417  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.140  -1.226  -2.842  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.130  -2.976  -2.519  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.406  -2.810  -1.549  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.416  -1.060  -1.872  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.111  -3.138  -3.939  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.509  -2.294  -3.625  1.00  0.00           H  
HETATM   59  H   UNL     1       1.079  -3.075   0.055  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.527  -2.807   2.005  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.182  -1.061   1.979  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.567   5.847   1.328  1.00  0.00           H  
CONECT    1   16    3    3   14                                       
CONECT    2   16   36   37                                            
CONECT    3    1    1                                                 
CONECT    4   25   14   33   20                                       
CONECT    4   20                                                      
CONECT    5   10   10    6                                            
CONECT    6    5    7    7   38                                       
CONECT    7    6    6    8                                            
CONECT    8    7    9    9   15                                       
CONECT    9    8    8   12   10                                       
CONECT   10    5    5    9   11                                       
CONECT   11   10   39   40                                            
CONECT   12    9   13   13                                            
CONECT   13   12   12   15   41                                       
CONECT   14    1    4   42                                            
CONECT   15    8   13   19                                            
CONECT   16    1    2   17   43                                       
CONECT   17   16   18   44   45                                       
CONECT   18   17   35   35   34                                       
CONECT   19   15   21   31   46                                       
CONECT   20    4    4                                                 
CONECT   21   19   22   23   47                                       
CONECT   22   21   48                                                 
CONECT   23   21   30   24   49                                       
CONECT   24   23   50                                                 
CONECT   25    4   26                                                 
CONECT   26   25   27   51   52                                       
CONECT   27   26   28   53   54                                       
CONECT   28   27   29   55   56                                       
CONECT   29   28   57   58                                            
CONECT   30   23   32   31   59                                       
CONECT   31   19   30                                                 
CONECT   32   30   33   60   61                                       
CONECT   33    4   32                                                 
CONECT   34   18   62                                                 
CONECT   35   18   18                                                 
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    6                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
CONECT   62   34                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
