COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.945  -1.162  -0.379  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.029  -0.058   0.154  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.494   1.296  -0.385  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.930   1.561   0.072  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.846   0.457  -0.461  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.381  -0.897   0.078  1.00  0.00           C  
HETATM    7  O   UNL     1       0.325   3.948  -1.821  1.00  0.00           O  
HETATM    8  P   UNL     1       1.224   3.290  -0.847  1.00  0.00           P  
HETATM    9  O   UNL     1       2.323   2.417  -1.637  1.00  0.00           O  
HETATM   10  O   UNL     1       1.965   4.409   0.042  1.00  0.00           O  
HETATM   11  O   UNL     1       0.362   2.326   0.112  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.364   2.825  -0.432  1.00  0.00           O  
HETATM   13  P   UNL     1      -2.827   4.037   0.522  1.00  0.00           P  
HETATM   14  O   UNL     1      -3.372   5.253  -0.381  1.00  0.00           O  
HETATM   15  O   UNL     1      -3.904   3.571   1.424  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.573   4.539   1.398  1.00  0.00           O  
HETATM   17  O   UNL     1      -2.796   0.444  -1.889  1.00  0.00           O  
HETATM   18  O   UNL     1      -3.237  -1.927  -0.420  1.00  0.00           O  
HETATM   19  P   UNL     1      -4.099  -2.891   0.540  1.00  0.00           P  
HETATM   20  O   UNL     1      -4.840  -4.010  -0.349  1.00  0.00           O  
HETATM   21  O   UNL     1      -3.200  -3.550   1.513  1.00  0.00           O  
HETATM   22  O   UNL     1      -5.198  -2.018   1.329  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.511  -2.427   0.124  1.00  0.00           O  
HETATM   24  P   UNL     1      -0.048  -3.638  -0.830  1.00  0.00           P  
HETATM   25  O   UNL     1       0.248  -4.943   0.065  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.123  -3.939  -1.801  1.00  0.00           O  
HETATM   27  O   UNL     1       1.288  -3.217  -1.622  1.00  0.00           O  
HETATM   28  O   UNL     1       1.312  -0.306  -0.273  1.00  0.00           O  
HETATM   29  P   UNL     1       2.533  -0.527   0.753  1.00  0.00           P  
HETATM   30  O   UNL     1       2.289  -1.879   1.593  1.00  0.00           O  
HETATM   31  O   UNL     1       2.611   0.623   1.682  1.00  0.00           O  
HETATM   32  O   UNL     1       3.911  -0.648  -0.070  1.00  0.00           O  
HETATM   33  P   UNL     1       5.467  -0.569   0.337  1.00  0.00           P  
HETATM   34  O   UNL     1       6.348  -0.246  -0.972  1.00  0.00           O  
HETATM   35  O   UNL     1       5.661   0.503   1.339  1.00  0.00           O  
HETATM   36  O   UNL     1       5.931  -1.978   0.962  1.00  0.00           O  
HETATM   37  H   UNL     1      -0.907  -1.171  -1.468  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.067  -0.049   1.243  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.455   1.286  -1.475  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.968   1.570   1.161  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.869   0.646  -0.135  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.420  -0.887   1.167  1.00  0.00           H  
HETATM   43  H   UNL     1       2.947   1.956  -1.060  1.00  0.00           H  
HETATM   44  H   UNL     1       2.504   5.026  -0.472  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.668   6.020   0.129  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.828   4.859   0.871  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.354  -0.232  -2.296  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.379  -4.627   0.165  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.822  -1.557   0.752  1.00  0.00           H  
HETATM   50  H   UNL     1       0.532  -5.714  -0.445  1.00  0.00           H  
HETATM   51  H   UNL     1       2.036  -3.005  -1.047  1.00  0.00           H  
HETATM   52  H   UNL     1       2.227  -2.675   1.048  1.00  0.00           H  
HETATM   53  H   UNL     1       7.298  -0.184  -0.801  1.00  0.00           H  
HETATM   54  H   UNL     1       5.831  -2.727   0.359  1.00  0.00           H  
CONECT    1    6    2   23   37                                       
CONECT    2    3    1   28   38                                       
CONECT    3    4   11    2   39                                       
CONECT    4   12    5    3   40                                       
CONECT    5    4   17    6   41                                       
CONECT    6    5   18    1   42                                       
CONECT    7    8    8                                                 
CONECT    8    7    7    9   11                                       
CONECT    8   10                                                      
CONECT    9    8   43                                                 
CONECT   10    8   44                                                 
CONECT   11    8    3                                                 
CONECT   12   13    4                                                 
CONECT   13   15   15   16   14                                       
CONECT   13   12                                                      
CONECT   14   13   45                                                 
CONECT   15   13   13                                                 
CONECT   16   13   46                                                 
CONECT   17    5   47                                                 
CONECT   18    6   19                                                 
CONECT   19   21   21   18   22                                       
CONECT   19   20                                                      
CONECT   20   19   48                                                 
CONECT   21   19   19                                                 
CONECT   22   19   49                                                 
CONECT   23    1   24                                                 
CONECT   24   23   26   26   27                                       
CONECT   24   25                                                      
CONECT   25   24   50                                                 
CONECT   26   24   24                                                 
CONECT   27   24   51                                                 
CONECT   28    2   29                                                 
CONECT   29   31   31   28   30                                       
CONECT   29   32                                                      
CONECT   30   29   52                                                 
CONECT   31   29   29                                                 
CONECT   32   29   33                                                 
CONECT   33   35   35   32   34                                       
CONECT   33   36                                                      
CONECT   34   33   53                                                 
CONECT   35   33   33                                                 
CONECT   36   33   54                                                 
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   30                                                      
CONECT   53   34                                                      
CONECT   54   36                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
