COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       8.733  -2.182   0.636  1.00  0.00           O  
HETATM    2  P   UNL     1       8.636  -0.791   0.139  1.00  0.00           P  
HETATM    3  O   UNL     1       9.071   0.227   1.308  1.00  0.00           O  
HETATM    4  O   UNL     1       9.611  -0.604  -1.128  1.00  0.00           O  
HETATM    5  O   UNL     1       7.118  -0.485  -0.302  1.00  0.00           O  
HETATM    6  C   UNL     1       6.002  -0.665   0.572  1.00  0.00           C  
HETATM    7  C   UNL     1       4.714  -0.283  -0.161  1.00  0.00           C  
HETATM    8  O   UNL     1       4.496  -1.189  -1.244  1.00  0.00           O  
HETATM    9  C   UNL     1       3.534  -0.356   0.810  1.00  0.00           C  
HETATM   10  O   UNL     1       3.752   0.550   1.894  1.00  0.00           O  
HETATM   11  C   UNL     1       2.246   0.025   0.078  1.00  0.00           C  
HETATM   12  O   UNL     1       2.028  -0.881  -1.006  1.00  0.00           O  
HETATM   13  C   UNL     1       1.066  -0.048   1.049  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.165   0.317   0.349  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.910  -0.675  -0.275  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.379  -1.876  -0.513  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.040  -2.784  -1.195  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.485  -3.996  -1.395  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.592   1.651   0.267  1.00  0.00           C  
HETATM   20  C   UNL     1       0.263   2.701   0.538  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.218   3.993   0.457  1.00  0.00           C  
HETATM   22  C   UNL     1       0.702   5.152   0.753  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.536   4.254   0.105  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.910   5.716   0.060  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.415   3.217  -0.172  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.921   1.923  -0.065  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.838   3.465  -0.591  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.873   4.282  -1.890  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.601   4.219   0.504  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.619   2.171  -0.871  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.173   1.091   0.119  1.00  0.00           C  
HETATM   32  N   UNL     1      -2.781   0.808  -0.215  1.00  0.00           N  
HETATM   33  C   UNL     1      -2.234  -0.405  -0.632  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.843  -1.307  -1.505  1.00  0.00           C  
HETATM   35  O   UNL     1      -3.835  -1.016  -2.160  1.00  0.00           O  
HETATM   36  N   UNL     1      -2.265  -2.514  -1.712  1.00  0.00           N  
HETATM   37  C   UNL     1      -5.094  -0.111   0.108  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.610  -1.134   1.137  1.00  0.00           C  
HETATM   39  C   UNL     1      -5.527  -2.330   1.126  1.00  0.00           C  
HETATM   40  C   UNL     1      -5.264  -3.395   0.285  1.00  0.00           C  
HETATM   41  C   UNL     1      -6.105  -4.492   0.275  1.00  0.00           C  
HETATM   42  C   UNL     1      -7.209  -4.524   1.105  1.00  0.00           C  
HETATM   43  C   UNL     1      -7.473  -3.459   1.946  1.00  0.00           C  
HETATM   44  C   UNL     1      -6.629  -2.364   1.961  1.00  0.00           C  
HETATM   45  H   UNL     1       9.031   1.159   1.052  1.00  0.00           H  
HETATM   46  H   UNL     1      10.544  -0.773  -0.934  1.00  0.00           H  
HETATM   47  H   UNL     1       5.948  -1.708   0.882  1.00  0.00           H  
HETATM   48  H   UNL     1       6.122  -0.031   1.450  1.00  0.00           H  
HETATM   49  H   UNL     1       4.803   0.732  -0.548  1.00  0.00           H  
HETATM   50  H   UNL     1       4.407  -2.113  -0.973  1.00  0.00           H  
HETATM   51  H   UNL     1       3.444  -1.371   1.198  1.00  0.00           H  
HETATM   52  H   UNL     1       3.841   1.473   1.622  1.00  0.00           H  
HETATM   53  H   UNL     1       2.335   1.040  -0.310  1.00  0.00           H  
HETATM   54  H   UNL     1       1.939  -1.804  -0.734  1.00  0.00           H  
HETATM   55  H   UNL     1       0.977  -1.063   1.436  1.00  0.00           H  
HETATM   56  H   UNL     1       1.232   0.643   1.875  1.00  0.00           H  
HETATM   57  H   UNL     1       1.294   2.537   0.810  1.00  0.00           H  
HETATM   58  H   UNL     1       1.101   5.547  -0.181  1.00  0.00           H  
HETATM   59  H   UNL     1       0.146   5.933   1.270  1.00  0.00           H  
HETATM   60  H   UNL     1       1.523   4.812   1.384  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.780   6.093  -0.955  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.951   5.834   0.361  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.270   6.276   0.741  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.507   5.290  -1.696  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.240   3.804  -2.638  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.897   4.332  -2.260  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.346   5.278   0.460  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.673   4.097   0.349  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.327   3.819   1.480  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.684   2.365  -0.752  1.00  0.00           H  
HETATM   71  H   UNL     1      -4.415   1.843  -1.890  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.192   1.529   1.135  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.730  -3.185  -2.234  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.107   0.205   0.359  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.089  -0.563  -0.884  1.00  0.00           H  
HETATM   76  H   UNL     1      -3.598  -1.451   0.887  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.615  -0.682   2.129  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.401  -3.371  -0.363  1.00  0.00           H  
HETATM   79  H   UNL     1      -5.899  -5.324  -0.382  1.00  0.00           H  
HETATM   80  H   UNL     1      -7.867  -5.381   1.097  1.00  0.00           H  
HETATM   81  H   UNL     1      -8.336  -3.483   2.595  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.832  -1.534   2.621  1.00  0.00           H  
HETATM   83  H   UNL     1       0.392  -4.097  -1.002  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    1    1    3                                       
CONECT    2    4                                                      
CONECT    3    2   45                                                 
CONECT    4    2   46                                                 
CONECT    5    6    2                                                 
CONECT    6    7    5   47   48                                       
CONECT    7    9    8    6   49                                       
CONECT    8    7   50                                                 
CONECT    9   11    7   10   51                                       
CONECT   10    9   52                                                 
CONECT   11   12   13    9   53                                       
CONECT   12   11   54                                                 
CONECT   13   14   11   55   56                                       
CONECT   14   19   13   15                                            
CONECT   15   14   33   33   16                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   36   18                                       
CONECT   18   17   83                                                 
CONECT   19   20   26   26   14                                       
CONECT   20   21   21   19   57                                       
CONECT   21   22   23   20   20                                       
CONECT   22   21   58   59   60                                       
CONECT   23   24   21   25   25                                       
CONECT   24   23   61   62   63                                       
CONECT   25   23   23   27   26                                       
CONECT   26   25   19   19   32                                       
CONECT   27   28   29   25   30                                       
CONECT   28   27   64   65   66                                       
CONECT   29   27   67   68   69                                       
CONECT   30   27   31   70   71                                       
CONECT   31   30   32   37   72                                       
CONECT   32   26   31   33                                            
CONECT   33   32   15   15   34                                       
CONECT   34   33   35   35   36                                       
CONECT   35   34   34                                                 
CONECT   36   34   17   73                                            
CONECT   37   31   38   74   75                                       
CONECT   38   37   39   76   77                                       
CONECT   39   38   44   44   40                                       
CONECT   40   39   41   41   78                                       
CONECT   41   40   40   42   79                                       
CONECT   42   43   43   41   80                                       
CONECT   43   44   42   42   81                                       
CONECT   44   39   39   43   82                                       
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    6                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   12                                                      
CONECT   55   13                                                      
CONECT   56   13                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   24                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   36                                                      
CONECT   74   37                                                      
CONECT   75   37                                                      
CONECT   76   38                                                      
CONECT   77   38                                                      
CONECT   78   40                                                      
CONECT   79   41                                                      
CONECT   80   42                                                      
CONECT   81   43                                                      
CONECT   82   44                                                      
CONECT   83   18                                                      
MASTER        0    0    0    0    0    0    0    0   83    0   83    0
END
