COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.941  -0.068   1.767  1.00  0.00           O  
HETATM    2  P   UNL     1       3.077   1.150   0.723  1.00  0.00           P  
HETATM    3  O   UNL     1       3.771   2.283   1.374  1.00  0.00           O  
HETATM    4  O   UNL     1       3.924   0.666  -0.558  1.00  0.00           O  
HETATM    5  C   UNL     1       5.300   0.289  -0.484  1.00  0.00           C  
HETATM    6  C   UNL     1       5.988   0.602  -1.815  1.00  0.00           C  
HETATM    7  O   UNL     1       5.944   2.010  -2.055  1.00  0.00           O  
HETATM    8  C   UNL     1       7.447   0.140  -1.748  1.00  0.00           C  
HETATM    9  O   UNL     1       8.135   0.873  -0.733  1.00  0.00           O  
HETATM   10  C   UNL     1       7.482  -1.355  -1.414  1.00  0.00           C  
HETATM   11  O   UNL     1       6.851  -2.094  -2.461  1.00  0.00           O  
HETATM   12  C   UNL     1       6.736  -1.593  -0.098  1.00  0.00           C  
HETATM   13  C   UNL     1       6.715  -3.091   0.212  1.00  0.00           C  
HETATM   14  C   UNL     1       5.970  -3.329   1.527  1.00  0.00           C  
HETATM   15  O   UNL     1       5.848  -4.734   1.758  1.00  0.00           O  
HETATM   16  O   UNL     1       8.056  -3.572   0.331  1.00  0.00           O  
HETATM   17  O   UNL     1       5.396  -1.112  -0.219  1.00  0.00           O  
HETATM   18  O   UNL     1       1.610   1.618   0.251  1.00  0.00           O  
HETATM   19  P   UNL     1       0.469   2.547   0.904  1.00  0.00           P  
HETATM   20  O   UNL     1       0.383   2.276   2.356  1.00  0.00           O  
HETATM   21  O   UNL     1       0.839   4.096   0.668  1.00  0.00           O  
HETATM   22  O   UNL     1      -0.948   2.222   0.212  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.178   2.807   0.645  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.324   2.286  -0.223  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.652   2.971   0.171  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.943   4.048  -0.722  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.707   1.850   0.036  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.686   2.198  -0.946  1.00  0.00           O  
HETATM   29  O   UNL     1      -3.544   0.880   0.026  1.00  0.00           O  
HETATM   30  C   UNL     1      -4.893   0.621  -0.424  1.00  0.00           C  
HETATM   31  N   UNL     1      -5.414  -0.598   0.200  1.00  0.00           N  
HETATM   32  C   UNL     1      -6.447  -1.357  -0.257  1.00  0.00           C  
HETATM   33  N   UNL     1      -7.292  -1.288  -1.335  1.00  0.00           N  
HETATM   34  C   UNL     1      -8.253  -2.231  -1.520  1.00  0.00           C  
HETATM   35  N   UNL     1      -9.076  -2.126  -2.608  1.00  0.00           N  
HETATM   36  C   UNL     1      -4.948  -1.182   1.341  1.00  0.00           C  
HETATM   37  N   UNL     1      -5.647  -2.250   1.600  1.00  0.00           N  
HETATM   38  C   UNL     1      -6.590  -2.407   0.642  1.00  0.00           C  
HETATM   39  C   UNL     1      -7.646  -3.393   0.391  1.00  0.00           C  
HETATM   40  O   UNL     1      -7.814  -4.333   1.151  1.00  0.00           O  
HETATM   41  N   UNL     1      -8.423  -3.240  -0.692  1.00  0.00           N  
HETATM   42  H   UNL     1       2.495  -0.847   1.407  1.00  0.00           H  
HETATM   43  H   UNL     1       5.787   0.845   0.317  1.00  0.00           H  
HETATM   44  H   UNL     1       5.476   0.078  -2.622  1.00  0.00           H  
HETATM   45  H   UNL     1       5.049   2.373  -2.105  1.00  0.00           H  
HETATM   46  H   UNL     1       7.928   0.309  -2.712  1.00  0.00           H  
HETATM   47  H   UNL     1       8.146   1.829  -0.878  1.00  0.00           H  
HETATM   48  H   UNL     1       8.517  -1.681  -1.311  1.00  0.00           H  
HETATM   49  H   UNL     1       7.269  -1.985  -3.326  1.00  0.00           H  
HETATM   50  H   UNL     1       7.242  -1.062   0.708  1.00  0.00           H  
HETATM   51  H   UNL     1       6.209  -3.622  -0.594  1.00  0.00           H  
HETATM   52  H   UNL     1       6.524  -2.872   2.347  1.00  0.00           H  
HETATM   53  H   UNL     1       4.977  -2.884   1.467  1.00  0.00           H  
HETATM   54  H   UNL     1       5.385  -4.959   2.576  1.00  0.00           H  
HETATM   55  H   UNL     1       8.567  -3.142   1.031  1.00  0.00           H  
HETATM   56  H   UNL     1       0.911   4.346  -0.263  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.360   2.542   1.686  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.116   3.892   0.552  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.108   2.455  -1.278  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.606   3.330   1.199  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.767   4.513  -0.521  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.182   1.657   0.998  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.226   2.964  -0.709  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.918   0.533  -1.510  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.203  -0.561  -1.970  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.769  -2.789  -2.758  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.967  -1.390  -3.230  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.126  -0.816   1.938  1.00  0.00           H  
CONECT    1    2   42                                                 
CONECT    2    3    3   18    1                                       
CONECT    2    4                                                      
CONECT    3    2    2                                                 
CONECT    4    2    5                                                 
CONECT    5    4   17    6   43                                       
CONECT    6    5    7    8   44                                       
CONECT    7    6   45                                                 
CONECT    8    9    6   10   46                                       
CONECT    9    8   47                                                 
CONECT   10    8   12   11   48                                       
CONECT   11   10   49                                                 
CONECT   12   17   10   13   50                                       
CONECT   13   12   14   16   51                                       
CONECT   14   13   15   52   53                                       
CONECT   15   14   54                                                 
CONECT   16   13   55                                                 
CONECT   17    5   12                                                 
CONECT   18    2   19                                                 
CONECT   19   18   22   20   20                                       
CONECT   19   21                                                      
CONECT   20   19   19                                                 
CONECT   21   19   56                                                 
CONECT   22   23   19                                                 
CONECT   23   24   22   57   58                                       
CONECT   24   25   29   23   59                                       
CONECT   25   26   27   24   60                                       
CONECT   26   25   61                                                 
CONECT   27   28   30   25   62                                       
CONECT   28   27   63                                                 
CONECT   29   30   24                                                 
CONECT   30   27   31   29   64                                       
CONECT   31   32   30   36                                            
CONECT   32   33   38   38   31                                       
CONECT   33   34   32   65                                            
CONECT   34   35   41   41   33                                       
CONECT   35   34   66   67                                            
CONECT   36   31   37   37   68                                       
CONECT   37   38   36   36                                            
CONECT   38   39   32   32   37                                       
CONECT   39   41   40   40   38                                       
CONECT   40   39   39                                                 
CONECT   41   34   34   39                                            
CONECT   42    1                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   21                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   30                                                      
CONECT   65   33                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
