COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -4.685   5.816   0.458  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.993   4.603   0.998  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.158   4.467   1.710  1.00  0.00           N  
HETATM    4  N   UNL     1      -4.206   3.560   0.856  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.060   3.646   0.170  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.689   4.865  -0.408  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.545   5.980  -0.248  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.261   7.061  -0.735  1.00  0.00           O  
HETATM    9  N   UNL     1      -1.502   4.668  -1.033  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.133   3.431  -0.877  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.065   2.760  -0.139  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.832  -2.543  -0.248  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.988  -2.539  -1.453  1.00  0.00           O  
HETATM   14  P   UNL     1       3.030  -1.344  -0.887  1.00  0.00           P  
HETATM   15  P   UNL     1       5.814  -0.595  -0.203  1.00  0.00           P  
HETATM   16  P   UNL     1       8.177   0.208   1.009  1.00  0.00           P  
HETATM   17  C   UNL     1      -2.009   1.349   0.250  1.00  0.00           C  
HETATM   18  O   UNL     1       3.153  -0.726  -2.226  1.00  0.00           O  
HETATM   19  O   UNL     1       6.001   0.530  -1.339  1.00  0.00           O  
HETATM   20  O   UNL     1       8.368   1.248  -0.026  1.00  0.00           O  
HETATM   21  C   UNL     1      -2.797   0.473  -0.757  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.181   0.413  -0.406  1.00  0.00           O  
HETATM   23  O   UNL     1       3.080  -2.947  -1.029  1.00  0.00           O  
HETATM   24  O   UNL     1       6.455  -1.854  -0.644  1.00  0.00           O  
HETATM   25  O   UNL     1       8.825   0.706   2.397  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.122  -0.909  -0.582  1.00  0.00           C  
HETATM   27  O   UNL     1      -2.901  -1.746   0.314  1.00  0.00           O  
HETATM   28  O   UNL     1       4.245  -0.850   0.047  1.00  0.00           O  
HETATM   29  N   UNL     1       6.532  -0.071   1.227  1.00  0.00           N  
HETATM   30  O   UNL     1       8.895  -1.155   0.540  1.00  0.00           O  
HETATM   31  C   UNL     1      -0.751  -0.584   0.041  1.00  0.00           C  
HETATM   32  O   UNL     1      -0.659   0.846   0.149  1.00  0.00           O  
HETATM   33  C   UNL     1       0.368  -1.110  -0.861  1.00  0.00           C  
HETATM   34  O   UNL     1       1.630  -0.908  -0.221  1.00  0.00           O  
HETATM   35  C   UNL     1      -4.660  -3.418   0.599  1.00  0.00           C  
HETATM   36  N   UNL     1      -5.969  -4.078  -1.327  1.00  0.00           N  
HETATM   37  C   UNL     1      -5.707  -4.163   0.033  1.00  0.00           C  
HETATM   38  C   UNL     1      -6.481  -4.986   0.843  1.00  0.00           C  
HETATM   39  C   UNL     1      -6.219  -5.068   2.195  1.00  0.00           C  
HETATM   40  C   UNL     1      -5.185  -4.334   2.757  1.00  0.00           C  
HETATM   41  C   UNL     1      -4.404  -3.518   1.970  1.00  0.00           C  
HETATM   42  C   UNL     1      -7.136  -4.758  -1.893  1.00  0.00           C  
HETATM   43  H   UNL     1      -5.290   6.565   0.578  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.749   5.227   1.823  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.391   3.609   2.100  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.224   3.000  -1.271  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.396   1.215   1.260  1.00  0.00           H  
HETATM   48  H   UNL     1       5.605   1.384  -1.117  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.671   0.842  -1.775  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.626   1.271  -0.413  1.00  0.00           H  
HETATM   51  H   UNL     1       3.004  -3.419  -0.189  1.00  0.00           H  
HETATM   52  H   UNL     1       9.774   0.886   2.345  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.998  -1.398  -1.548  1.00  0.00           H  
HETATM   54  H   UNL     1       6.070   0.752   1.584  1.00  0.00           H  
HETATM   55  H   UNL     1       8.810  -1.882   1.172  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.676  -1.036   1.030  1.00  0.00           H  
HETATM   57  H   UNL     1       0.219  -2.175  -1.042  1.00  0.00           H  
HETATM   58  H   UNL     1       0.352  -0.575  -1.810  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.378  -3.569  -1.904  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.288  -5.561   0.414  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.823  -5.708   2.821  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.990  -4.406   3.816  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.598  -2.951   2.411  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.059  -5.829  -1.706  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.043  -4.373  -1.426  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.176  -4.579  -2.967  1.00  0.00           H  
CONECT    1    2    7   43                                            
CONECT    2    1    3    4    4                                       
CONECT    3    2   44   45                                            
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   46                                       
CONECT   11    5   10   17                                            
CONECT   12   13   13   27   35                                       
CONECT   13   12   12                                                 
CONECT   14   18   18   23   28                                       
CONECT   14   34                                                      
CONECT   15   19   24   24   28                                       
CONECT   15   29                                                      
CONECT   16   20   20   25   29                                       
CONECT   16   30                                                      
CONECT   17   11   21   32   47                                       
CONECT   18   14   14                                                 
CONECT   19   15   48                                                 
CONECT   20   16   16                                                 
CONECT   21   17   22   26   49                                       
CONECT   22   21   50                                                 
CONECT   23   14   51                                                 
CONECT   24   15   15                                                 
CONECT   25   16   52                                                 
CONECT   26   21   27   31   53                                       
CONECT   27   12   26                                                 
CONECT   28   14   15                                                 
CONECT   29   15   16   54                                            
CONECT   30   16   55                                                 
CONECT   31   26   32   33   56                                       
CONECT   32   17   31                                                 
CONECT   33   31   34   57   58                                       
CONECT   34   14   33                                                 
CONECT   35   12   37   37   41                                       
CONECT   36   37   42   59                                            
CONECT   37   35   35   36   38                                       
CONECT   38   37   39   39   60                                       
CONECT   39   38   38   40   61                                       
CONECT   40   39   41   41   62                                       
CONECT   41   35   40   40   63                                       
CONECT   42   36   64   65   66                                       
CONECT   43    1                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46   10                                                      
CONECT   47   17                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
CONECT   59   36                                                      
CONECT   60   38                                                      
CONECT   61   39                                                      
CONECT   62   40                                                      
CONECT   63   41                                                      
CONECT   64   42                                                      
CONECT   65   42                                                      
CONECT   66   42                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
