COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      12.995   5.080   0.757  1.00  0.00           C  
HETATM    2  C   UNL     1      11.736   4.436   1.341  1.00  0.00           C  
HETATM    3  C   UNL     1      10.935   3.772   0.218  1.00  0.00           C  
HETATM    4  C   UNL     1       8.875   2.464  -0.320  1.00  0.00           C  
HETATM    5  C   UNL     1       5.557   0.512  -0.274  1.00  0.00           C  
HETATM    6  C   UNL     1       2.911  -1.381  -2.213  1.00  0.00           C  
HETATM    7  C   UNL     1       1.984  -3.040  -0.591  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.579  -0.283  -0.750  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.010   0.210  -0.443  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.439   0.702  -0.136  1.00  0.00           C  
HETATM   11  C   UNL     1       7.617   1.820   0.264  1.00  0.00           C  
HETATM   12  C   UNL     1       6.816   1.156  -0.858  1.00  0.00           C  
HETATM   13  C   UNL     1       4.768  -0.142  -1.379  1.00  0.00           C  
HETATM   14  C   UNL     1       1.633  -2.049  -1.703  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.584  -1.288  -1.270  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.999  -0.811  -0.971  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.429  -0.318  -0.663  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.859   0.175  -0.356  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.870   1.195   0.171  1.00  0.00           C  
HETATM   20  C   UNL     1     -10.289   0.668  -0.049  1.00  0.00           C  
HETATM   21  C   UNL     1     -11.300   1.688   0.479  1.00  0.00           C  
HETATM   22  C   UNL     1     -12.719   1.161   0.258  1.00  0.00           C  
HETATM   23  C   UNL     1     -13.730   2.181   0.786  1.00  0.00           C  
HETATM   24  C   UNL     1     -15.149   1.654   0.565  1.00  0.00           C  
HETATM   25  C   UNL     1     -16.160   2.674   1.093  1.00  0.00           C  
HETATM   26  C   UNL     1       9.676   3.128   0.803  1.00  0.00           C  
HETATM   27  O   UNL     1       5.172  -0.097  -2.517  1.00  0.00           O  
HETATM   28  O   UNL     1       3.618  -0.774  -1.099  1.00  0.00           O  
HETATM   29  O   UNL     1       2.722  -2.367   0.431  1.00  0.00           O  
HETATM   30  O   UNL     1       3.927  -2.023   2.742  1.00  0.00           O  
HETATM   31  O   UNL     1       2.125  -3.765   2.446  1.00  0.00           O  
HETATM   32  O   UNL     1       4.354  -4.212   1.350  1.00  0.00           O  
HETATM   33  O   UNL     1       0.732  -1.037  -1.182  1.00  0.00           O  
HETATM   34  O   UNL     1      -0.970  -2.320  -1.765  1.00  0.00           O  
HETATM   35  P   UNL     1       3.257  -3.106   1.758  1.00  0.00           P  
HETATM   36  H   UNL     1      13.606   4.315   0.278  1.00  0.00           H  
HETATM   37  H   UNL     1      12.710   5.832   0.020  1.00  0.00           H  
HETATM   38  H   UNL     1      13.565   5.553   1.556  1.00  0.00           H  
HETATM   39  H   UNL     1      12.021   3.684   2.077  1.00  0.00           H  
HETATM   40  H   UNL     1      11.125   5.201   1.820  1.00  0.00           H  
HETATM   41  H   UNL     1      10.650   4.523  -0.518  1.00  0.00           H  
HETATM   42  H   UNL     1      11.546   3.007  -0.261  1.00  0.00           H  
HETATM   43  H   UNL     1       9.486   1.699  -0.799  1.00  0.00           H  
HETATM   44  H   UNL     1       8.591   3.216  -1.056  1.00  0.00           H  
HETATM   45  H   UNL     1       5.842  -0.240   0.463  1.00  0.00           H  
HETATM   46  H   UNL     1       4.946   1.277   0.205  1.00  0.00           H  
HETATM   47  H   UNL     1       3.549  -2.129  -2.684  1.00  0.00           H  
HETATM   48  H   UNL     1       2.653  -0.612  -2.941  1.00  0.00           H  
HETATM   49  H   UNL     1       1.068  -3.450  -0.167  1.00  0.00           H  
HETATM   50  H   UNL     1       2.588  -3.849  -1.002  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.412  -0.124   0.315  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.456   0.660  -1.283  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.842   0.369   0.622  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.885   1.153  -0.975  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.273   0.862   0.929  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.316   1.645  -0.668  1.00  0.00           H  
HETATM   57  H   UNL     1       7.901   1.068   1.001  1.00  0.00           H  
HETATM   58  H   UNL     1       7.006   2.585   0.743  1.00  0.00           H  
HETATM   59  H   UNL     1       7.427   0.391  -1.337  1.00  0.00           H  
HETATM   60  H   UNL     1       6.531   1.907  -1.594  1.00  0.00           H  
HETATM   61  H   UNL     1       1.148  -2.580  -2.522  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.166  -0.970  -2.036  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.123  -1.754  -0.438  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.596  -0.477  -1.729  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.553  -1.261  -0.131  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.026   0.016  -1.421  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.983  -0.768   0.176  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.703   1.355   1.237  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.746   2.138  -0.361  1.00  0.00           H  
HETATM   70  H   UNL     1     -10.456   0.508  -1.114  1.00  0.00           H  
HETATM   71  H   UNL     1     -10.413  -0.275   0.483  1.00  0.00           H  
HETATM   72  H   UNL     1     -11.133   1.848   1.544  1.00  0.00           H  
HETATM   73  H   UNL     1     -11.176   2.631  -0.054  1.00  0.00           H  
HETATM   74  H   UNL     1     -12.886   1.001  -0.807  1.00  0.00           H  
HETATM   75  H   UNL     1     -12.843   0.218   0.790  1.00  0.00           H  
HETATM   76  H   UNL     1     -13.563   2.341   1.851  1.00  0.00           H  
HETATM   77  H   UNL     1     -13.606   3.124   0.253  1.00  0.00           H  
HETATM   78  H   UNL     1     -15.316   1.494  -0.500  1.00  0.00           H  
HETATM   79  H   UNL     1     -15.273   0.711   1.098  1.00  0.00           H  
HETATM   80  H   UNL     1     -17.171   2.298   0.936  1.00  0.00           H  
HETATM   81  H   UNL     1     -15.993   2.833   2.158  1.00  0.00           H  
HETATM   82  H   UNL     1     -16.036   3.617   0.560  1.00  0.00           H  
HETATM   83  H   UNL     1       9.961   2.376   1.539  1.00  0.00           H  
HETATM   84  H   UNL     1       9.065   3.893   1.281  1.00  0.00           H  
HETATM   85  H   UNL     1       4.273  -2.398   3.564  1.00  0.00           H  
HETATM   86  H   UNL     1       5.126  -3.850   0.894  1.00  0.00           H  
CONECT    1    2   36   37   38                                       
CONECT    2    3    1   39   40                                       
CONECT    3   26    2   41   42                                       
CONECT    4   11   26   43   44                                       
CONECT    5   13   12   45   46                                       
CONECT    6   14   28   47   48                                       
CONECT    7   29   14   49   50                                       
CONECT    8   15   16   51   52                                       
CONECT    9   16   17   53   54                                       
CONECT   10   17   18   55   56                                       
CONECT   11   12    4   57   58                                       
CONECT   12    5   11   59   60                                       
CONECT   13   28   27   27    5                                       
CONECT   14    7   33    6   61                                       
CONECT   15   34   34   33    8                                       
CONECT   16    8    9   62   63                                       
CONECT   17    9   10   64   65                                       
CONECT   18   10   19   66   67                                       
CONECT   19   18   20   68   69                                       
CONECT   20   19   21   70   71                                       
CONECT   21   20   22   72   73                                       
CONECT   22   21   23   74   75                                       
CONECT   23   22   24   76   77                                       
CONECT   24   23   25   78   79                                       
CONECT   25   24   80   81   82                                       
CONECT   26    4    3   83   84                                       
CONECT   27   13   13                                                 
CONECT   28    6   13                                                 
CONECT   29   35    7                                                 
CONECT   30   35   85                                                 
CONECT   31   35   35                                                 
CONECT   32   35   86                                                 
CONECT   33   14   15                                                 
CONECT   34   15   15                                                 
CONECT   35   31   31   30   32                                       
CONECT   35   29                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    5                                                      
CONECT   47    6                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    7                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54    9                                                      
CONECT   55   10                                                      
CONECT   56   10                                                      
CONECT   57   11                                                      
CONECT   58   11                                                      
CONECT   59   12                                                      
CONECT   60   12                                                      
CONECT   61   14                                                      
CONECT   62   16                                                      
CONECT   63   16                                                      
CONECT   64   17                                                      
CONECT   65   17                                                      
CONECT   66   18                                                      
CONECT   67   18                                                      
CONECT   68   19                                                      
CONECT   69   19                                                      
CONECT   70   20                                                      
CONECT   71   20                                                      
CONECT   72   21                                                      
CONECT   73   21                                                      
CONECT   74   22                                                      
CONECT   75   22                                                      
CONECT   76   23                                                      
CONECT   77   23                                                      
CONECT   78   24                                                      
CONECT   79   24                                                      
CONECT   80   25                                                      
CONECT   81   25                                                      
CONECT   82   25                                                      
CONECT   83   26                                                      
CONECT   84   26                                                      
CONECT   85   30                                                      
CONECT   86   32                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
