COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.803   1.098  -2.428  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.995   1.024  -3.794  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.801   0.028  -4.328  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.411  -0.890  -3.487  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.212  -0.816  -2.122  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.413   0.180  -1.593  1.00  0.00           C  
HETATM    7  P   UNL     1      -0.830  -0.997  -6.253  1.00  0.00           P  
HETATM    8  O   UNL     1      -0.995  -1.131  -7.849  1.00  0.00           O  
HETATM    9  O   UNL     1      -0.933  -2.337  -5.633  1.00  0.00           O  
HETATM   10  O   UNL     1       0.608  -0.358  -5.914  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.203   0.263  -0.103  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.278   1.158   0.515  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.068   1.241   2.004  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.662   0.348   2.820  1.00  0.00           N  
HETATM   15  N   UNL     1      -2.191   2.500  -0.066  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.057   3.218   0.062  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.967   4.598  -0.534  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.109   2.752   0.660  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.363   2.112   2.470  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.457   0.428   4.268  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.529  -0.394   4.986  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.891  -1.627   4.178  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.766  -2.640   4.069  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.606  -2.081   3.242  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.716  -1.319   4.134  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.096  -0.134   4.622  1.00  0.00           C  
HETATM   27  C   UNL     1       0.596  -1.863   4.488  1.00  0.00           C  
HETATM   28  C   UNL     1       1.619  -1.398   3.483  1.00  0.00           C  
HETATM   29  O   UNL     1      -0.352   0.485   5.351  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.991  -0.046  -5.671  1.00  0.00           O  
HETATM   31  C   UNL     1       1.871  -2.158   2.355  1.00  0.00           C  
HETATM   32  C   UNL     1       2.803  -1.735   1.429  1.00  0.00           C  
HETATM   33  C   UNL     1       3.498  -0.546   1.637  1.00  0.00           C  
HETATM   34  C   UNL     1       3.244   0.212   2.778  1.00  0.00           C  
HETATM   35  C   UNL     1       2.307  -0.217   3.695  1.00  0.00           C  
HETATM   36  C   UNL     1       4.505  -0.089   0.648  1.00  0.00           C  
HETATM   37  C   UNL     1       4.598   1.261   0.317  1.00  0.00           C  
HETATM   38  C   UNL     1       5.541   1.681  -0.598  1.00  0.00           C  
HETATM   39  C   UNL     1       6.384   0.763  -1.197  1.00  0.00           C  
HETATM   40  C   UNL     1       6.293  -0.578  -0.877  1.00  0.00           C  
HETATM   41  C   UNL     1       5.358  -1.009   0.042  1.00  0.00           C  
HETATM   42  H   UNL     1      -0.176   1.873  -2.012  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.519   1.741  -4.446  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.039  -1.666  -3.900  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.687  -1.531  -1.468  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.282  -1.708  -8.157  1.00  0.00           H  
HETATM   47  H   UNL     1       0.633   0.511  -6.336  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.218   0.684   0.101  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.268  -0.734   0.329  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.263   0.737   0.310  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.225  -0.348   2.448  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.948   2.872  -0.543  1.00  0.00           H  
HETATM   53  H   UNL     1       0.017   5.019  -0.330  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.119   4.538  -1.612  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.733   5.235  -0.094  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.518   1.468   4.589  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.420   0.218   5.124  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.152  -0.702   5.961  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.175  -1.314   3.173  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.749  -2.110   4.645  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.143  -3.544   3.591  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.407  -2.886   5.068  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.995  -1.423   2.465  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.053  -2.901   2.787  1.00  0.00           H  
HETATM   65  H   UNL     1       0.552  -2.952   4.485  1.00  0.00           H  
HETATM   66  H   UNL     1       0.879  -1.513   5.481  1.00  0.00           H  
HETATM   67  H   UNL     1       1.331  -3.080   2.194  1.00  0.00           H  
HETATM   68  H   UNL     1       2.996  -2.327   0.546  1.00  0.00           H  
HETATM   69  H   UNL     1       3.780   1.135   2.945  1.00  0.00           H  
HETATM   70  H   UNL     1       2.109   0.370   4.579  1.00  0.00           H  
HETATM   71  H   UNL     1       3.939   1.978   0.784  1.00  0.00           H  
HETATM   72  H   UNL     1       5.617   2.729  -0.851  1.00  0.00           H  
HETATM   73  H   UNL     1       7.117   1.096  -1.916  1.00  0.00           H  
HETATM   74  H   UNL     1       6.954  -1.291  -1.347  1.00  0.00           H  
HETATM   75  H   UNL     1       5.288  -2.057   0.292  1.00  0.00           H  
CONECT    1    2    2    6   42                                       
CONECT    2    1    1    3   43                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    5   44                                       
CONECT    5    4    6    6   45                                       
CONECT    6    1    5    5   11                                       
CONECT    7    8    9    9   10                                       
CONECT    7   30                                                      
CONECT    8    7   46                                                 
CONECT    9    7    7                                                 
CONECT   10    7   47                                                 
CONECT   11    6   12   48   49                                       
CONECT   12   11   13   15   50                                       
CONECT   13   12   14   19   19                                       
CONECT   14   13   20   51                                            
CONECT   15   12   16   52                                            
CONECT   16   15   17   18   18                                       
CONECT   17   16   53   54   55                                       
CONECT   18   16   16                                                 
CONECT   19   13   13                                                 
CONECT   20   14   21   26   56                                       
CONECT   21   20   22   57   58                                       
CONECT   22   21   23   59   60                                       
CONECT   23   22   24   61   62                                       
CONECT   24   23   25   63   64                                       
CONECT   25   24   26   27                                            
CONECT   26   20   25   29   29                                       
CONECT   27   25   28   65   66                                       
CONECT   28   27   31   35   35                                       
CONECT   29   26   26                                                 
CONECT   30    3    7                                                 
CONECT   31   28   32   32   67                                       
CONECT   32   31   31   33   68                                       
CONECT   33   32   34   34   36                                       
CONECT   34   33   33   35   69                                       
CONECT   35   28   28   34   70                                       
CONECT   36   33   37   41   41                                       
CONECT   37   36   38   38   71                                       
CONECT   38   37   37   39   72                                       
CONECT   39   38   40   40   73                                       
CONECT   40   39   39   41   74                                       
CONECT   41   36   36   40   75                                       
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    8                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   34                                                      
CONECT   70   35                                                      
CONECT   71   37                                                      
CONECT   72   38                                                      
CONECT   73   39                                                      
CONECT   74   40                                                      
CONECT   75   41                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
