COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.375  -0.598   0.760  1.00  0.00           C  
HETATM    2  O   UNL     1       1.978  -0.552   0.462  1.00  0.00           O  
HETATM    3  P   UNL     1       0.926  -1.634   1.021  1.00  0.00           P  
HETATM    4  C   UNL     1       3.786   0.688   1.480  1.00  0.00           C  
HETATM    5  O   UNL     1       3.515   1.812   0.640  1.00  0.00           O  
HETATM    6  C   UNL     1       5.281   0.638   1.799  1.00  0.00           C  
HETATM    7  O   UNL     1       5.665   1.839   2.472  1.00  0.00           O  
HETATM    8  C   UNL     1       6.076   0.506   0.499  1.00  0.00           C  
HETATM    9  O   UNL     1       7.473   0.460   0.797  1.00  0.00           O  
HETATM   10  P   UNL     1       8.525   1.542   0.237  1.00  0.00           P  
HETATM   11  C   UNL     1       5.665  -0.780  -0.222  1.00  0.00           C  
HETATM   12  O   UNL     1       6.408  -0.903  -1.436  1.00  0.00           O  
HETATM   13  P   UNL     1       7.383  -2.147  -1.746  1.00  0.00           P  
HETATM   14  C   UNL     1       4.170  -0.730  -0.541  1.00  0.00           C  
HETATM   15  O   UNL     1       3.786  -1.931  -1.213  1.00  0.00           O  
HETATM   16  O   UNL     1       1.262  -3.081   0.400  1.00  0.00           O  
HETATM   17  O   UNL     1       1.021  -1.697   2.497  1.00  0.00           O  
HETATM   18  O   UNL     1      -0.566  -1.201   0.598  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.695   1.031   0.221  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.089   0.730  -0.881  1.00  0.00           O  
HETATM   21  C   UNL     1      -6.560  -2.088   0.378  1.00  0.00           C  
HETATM   22  O   UNL     1      -6.615  -3.065   1.088  1.00  0.00           O  
HETATM   23  C   UNL     1      -1.733  -1.902   1.033  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.864   2.442   0.722  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.814  -1.553  -0.264  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.978  -1.230   0.450  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.107   0.108   0.998  1.00  0.00           O  
HETATM   28  C   UNL     1      -4.557   3.285  -0.350  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.006  -2.421   0.142  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.217  -2.052   0.812  1.00  0.00           C  
HETATM   31  O   UNL     1      -5.383  -1.481   0.161  1.00  0.00           O  
HETATM   32  O   UNL     1       8.612   1.427  -1.366  1.00  0.00           O  
HETATM   33  O   UNL     1       8.079   2.903   0.611  1.00  0.00           O  
HETATM   34  O   UNL     1       9.976   1.259   0.875  1.00  0.00           O  
HETATM   35  C   UNL     1      -4.729   4.717   0.160  1.00  0.00           C  
HETATM   36  C   UNL     1     -10.279  -1.877  -0.510  1.00  0.00           C  
HETATM   37  O   UNL     1       6.513  -3.497  -1.851  1.00  0.00           O  
HETATM   38  O   UNL     1       8.151  -1.893  -3.138  1.00  0.00           O  
HETATM   39  O   UNL     1       8.373  -2.281  -0.654  1.00  0.00           O  
HETATM   40  C   UNL     1      -5.422   5.560  -0.913  1.00  0.00           C  
HETATM   41  C   UNL     1     -11.471  -2.746  -0.104  1.00  0.00           C  
HETATM   42  C   UNL     1      -5.594   6.993  -0.403  1.00  0.00           C  
HETATM   43  C   UNL     1     -12.744  -2.202  -0.755  1.00  0.00           C  
HETATM   44  C   UNL     1      -6.287   7.836  -1.475  1.00  0.00           C  
HETATM   45  C   UNL     1     -13.936  -3.071  -0.349  1.00  0.00           C  
HETATM   46  C   UNL     1      -6.459   9.268  -0.966  1.00  0.00           C  
HETATM   47  C   UNL     1     -15.209  -2.527  -1.001  1.00  0.00           C  
HETATM   48  H   UNL     1       3.582  -1.455   1.401  1.00  0.00           H  
HETATM   49  H   UNL     1       3.219   0.782   2.407  1.00  0.00           H  
HETATM   50  H   UNL     1       5.488  -0.219   2.440  1.00  0.00           H  
HETATM   51  H   UNL     1       5.870   1.363  -0.142  1.00  0.00           H  
HETATM   52  H   UNL     1       5.872  -1.637   0.419  1.00  0.00           H  
HETATM   53  H   UNL     1       3.963   0.127  -1.181  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.684  -2.936   0.691  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.785  -1.882   2.121  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.082  -3.080   0.478  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.360  -2.036   1.892  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.471   2.435   1.628  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.951   3.291  -1.255  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.336   4.711   1.065  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.815   5.567  -1.818  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.201   6.986   0.502  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.680   7.842  -2.381  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.953   9.869  -1.730  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.886   2.868   0.944  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.536   2.858  -0.571  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.750   5.144   0.381  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.400   5.134  -1.134  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.615   7.419  -0.182  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.265   7.409  -1.697  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.065   9.262  -0.060  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.480   9.695  -0.745  1.00  0.00           H  
HETATM   73  H   UNL     1      -7.982  -0.527   0.066  1.00  0.00           H  
HETATM   74  H   UNL     1      -8.838  -3.446  -0.188  1.00  0.00           H  
HETATM   75  H   UNL     1     -10.447  -0.852  -0.179  1.00  0.00           H  
HETATM   76  H   UNL     1     -11.303  -3.771  -0.434  1.00  0.00           H  
HETATM   77  H   UNL     1     -12.912  -1.177  -0.425  1.00  0.00           H  
HETATM   78  H   UNL     1     -13.768  -4.096  -0.679  1.00  0.00           H  
HETATM   79  H   UNL     1     -15.099  -2.545  -2.085  1.00  0.00           H  
HETATM   80  H   UNL     1      -7.703  -1.571  -1.348  1.00  0.00           H  
HETATM   81  H   UNL     1      -9.117  -2.402   1.226  1.00  0.00           H  
HETATM   82  H   UNL     1     -10.168  -1.896  -1.594  1.00  0.00           H  
HETATM   83  H   UNL     1     -11.582  -2.727   0.981  1.00  0.00           H  
HETATM   84  H   UNL     1     -12.634  -2.221  -1.840  1.00  0.00           H  
HETATM   85  H   UNL     1     -14.047  -3.052   0.735  1.00  0.00           H  
HETATM   86  H   UNL     1     -16.059  -3.145  -0.711  1.00  0.00           H  
HETATM   87  H   UNL     1     -15.377  -1.502  -0.670  1.00  0.00           H  
HETATM   88  H   UNL     1      -2.885  -1.171  -0.635  1.00  0.00           H  
HETATM   89  H   UNL     1       3.751   2.663   1.034  1.00  0.00           H  
HETATM   90  H   UNL     1       5.200   1.988   3.307  1.00  0.00           H  
HETATM   91  H   UNL     1       2.849  -1.969  -1.447  1.00  0.00           H  
HETATM   92  H   UNL     1       8.899   0.560  -1.683  1.00  0.00           H  
HETATM   93  H   UNL     1      10.662   1.875   0.581  1.00  0.00           H  
HETATM   94  H   UNL     1       5.843  -3.480  -2.547  1.00  0.00           H  
HETATM   95  H   UNL     1       8.757  -2.604  -3.388  1.00  0.00           H  
HETATM   96  H   UNL     1       1.219  -3.113  -0.566  1.00  0.00           H  
CONECT    1    2    4   14   48                                       
CONECT    2    1    3                                                 
CONECT    3    2   16   17   17                                       
CONECT    3   18                                                      
CONECT    4    1    5    6   49                                       
CONECT    5    4   89                                                 
CONECT    6    4    7    8   50                                       
CONECT    7    6   90                                                 
CONECT    8    6    9   11   51                                       
CONECT    9    8   10                                                 
CONECT   10    9   32   33   33                                       
CONECT   10   34                                                      
CONECT   11    8   12   14   52                                       
CONECT   12   11   13                                                 
CONECT   13   12   37   38   39                                       
CONECT   13   39                                                      
CONECT   14    1   11   15   53                                       
CONECT   15   14   91                                                 
CONECT   16    3   96                                                 
CONECT   17    3    3                                                 
CONECT   18    3   23                                                 
CONECT   19   20   20   24   27                                       
CONECT   20   19   19                                                 
CONECT   21   22   22   25   31                                       
CONECT   22   21   21                                                 
CONECT   23   18   26   54   55                                       
CONECT   24   19   28   58   65                                       
CONECT   25   21   29   73   80                                       
CONECT   26   23   27   30   88                                       
CONECT   27   19   26                                                 
CONECT   28   24   35   59   66                                       
CONECT   29   25   36   74   81                                       
CONECT   30   26   31   56   57                                       
CONECT   31   21   30                                                 
CONECT   32   10   92                                                 
CONECT   33   10   10                                                 
CONECT   34   10   93                                                 
CONECT   35   28   40   60   67                                       
CONECT   36   29   41   75   82                                       
CONECT   37   13   94                                                 
CONECT   38   13   95                                                 
CONECT   39   13   13                                                 
CONECT   40   35   42   61   68                                       
CONECT   41   36   43   76   83                                       
CONECT   42   40   44   62   69                                       
CONECT   43   41   45   77   84                                       
CONECT   44   42   46   63   70                                       
CONECT   45   43   47   78   85                                       
CONECT   46   44   64   71   72                                       
CONECT   47   45   79   86   87                                       
CONECT   48    1                                                      
CONECT   49    4                                                      
CONECT   50    6                                                      
CONECT   51    8                                                      
CONECT   52   11                                                      
CONECT   53   14                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   24                                                      
CONECT   59   28                                                      
CONECT   60   35                                                      
CONECT   61   40                                                      
CONECT   62   42                                                      
CONECT   63   44                                                      
CONECT   64   46                                                      
CONECT   65   24                                                      
CONECT   66   28                                                      
CONECT   67   35                                                      
CONECT   68   40                                                      
CONECT   69   42                                                      
CONECT   70   44                                                      
CONECT   71   46                                                      
CONECT   72   46                                                      
CONECT   73   25                                                      
CONECT   74   29                                                      
CONECT   75   36                                                      
CONECT   76   41                                                      
CONECT   77   43                                                      
CONECT   78   45                                                      
CONECT   79   47                                                      
CONECT   80   25                                                      
CONECT   81   29                                                      
CONECT   82   36                                                      
CONECT   83   41                                                      
CONECT   84   43                                                      
CONECT   85   45                                                      
CONECT   86   47                                                      
CONECT   87   47                                                      
CONECT   88   26                                                      
CONECT   89    5                                                      
CONECT   90    7                                                      
CONECT   91   15                                                      
CONECT   92   32                                                      
CONECT   93   34                                                      
CONECT   94   37                                                      
CONECT   95   38                                                      
CONECT   96   16                                                      
MASTER        0    0    0    0    0    0    0    0   96    0   96    0
END
