COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.766   2.819  -0.382  1.00  0.00           C  
HETATM    2  C   UNL     1       5.796   3.413   0.323  1.00  0.00           C  
HETATM    3  C   UNL     1       6.508   2.682   1.255  1.00  0.00           C  
HETATM    4  C   UNL     1       6.190   1.356   1.483  1.00  0.00           C  
HETATM    5  C   UNL     1       5.159   0.762   0.779  1.00  0.00           C  
HETATM    6  C   UNL     1       4.444   1.495  -0.149  1.00  0.00           C  
HETATM    7  C   UNL     1       3.320   0.847  -0.917  1.00  0.00           C  
HETATM    8  O   UNL     1       2.096   1.011  -0.198  1.00  0.00           O  
HETATM    9  C   UNL     1       0.961   0.429  -0.843  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.295   1.225  -0.482  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.142   2.578  -0.916  1.00  0.00           O  
HETATM   12  P   UNL     1      -0.188   3.833   0.093  1.00  0.00           P  
HETATM   13  O   UNL     1      -1.449   3.798   0.866  1.00  0.00           O  
HETATM   14  O   UNL     1       1.063   3.756   1.103  1.00  0.00           O  
HETATM   15  O   UNL     1      -0.113   5.202  -0.751  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.510   0.603  -1.173  1.00  0.00           C  
HETATM   17  O   UNL     1      -2.682   1.346  -0.836  1.00  0.00           O  
HETATM   18  P   UNL     1      -3.602   2.079  -1.935  1.00  0.00           P  
HETATM   19  O   UNL     1      -4.900   2.705  -1.217  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.760   3.255  -2.642  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.029   1.096  -2.956  1.00  0.00           O  
HETATM   22  C   UNL     1       0.797  -1.020  -0.379  1.00  0.00           C  
HETATM   23  O   UNL     1       1.970  -1.763  -0.717  1.00  0.00           O  
HETATM   24  P   UNL     1       2.890  -2.496   0.383  1.00  0.00           P  
HETATM   25  O   UNL     1       3.317  -1.513   1.403  1.00  0.00           O  
HETATM   26  O   UNL     1       2.048  -3.672   1.089  1.00  0.00           O  
HETATM   27  O   UNL     1       4.188  -3.122  -0.335  1.00  0.00           O  
HETATM   28  C   UNL     1      -0.418  -1.642  -1.070  1.00  0.00           C  
HETATM   29  O   UNL     1      -0.571  -2.995  -0.636  1.00  0.00           O  
HETATM   30  P   UNL     1      -0.524  -4.250  -1.645  1.00  0.00           P  
HETATM   31  O   UNL     1      -0.599  -5.619  -0.801  1.00  0.00           O  
HETATM   32  O   UNL     1      -1.775  -4.172  -2.655  1.00  0.00           O  
HETATM   33  O   UNL     1       0.737  -4.215  -2.418  1.00  0.00           O  
HETATM   34  C   UNL     1      -1.673  -0.846  -0.709  1.00  0.00           C  
HETATM   35  O   UNL     1      -1.864  -0.874   0.707  1.00  0.00           O  
HETATM   36  C   UNL     1      -3.233  -0.794   1.111  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.315  -0.832   2.615  1.00  0.00           C  
HETATM   38  C   UNL     1      -3.427  -2.044   3.271  1.00  0.00           C  
HETATM   39  C   UNL     1      -3.503  -2.078   4.651  1.00  0.00           C  
HETATM   40  C   UNL     1      -3.467  -0.901   5.375  1.00  0.00           C  
HETATM   41  C   UNL     1      -3.355   0.311   4.719  1.00  0.00           C  
HETATM   42  C   UNL     1      -3.274   0.345   3.339  1.00  0.00           C  
HETATM   43  H   UNL     1       4.210   3.390  -1.110  1.00  0.00           H  
HETATM   44  H   UNL     1       6.045   4.449   0.144  1.00  0.00           H  
HETATM   45  H   UNL     1       7.313   3.146   1.805  1.00  0.00           H  
HETATM   46  H   UNL     1       6.746   0.784   2.211  1.00  0.00           H  
HETATM   47  H   UNL     1       4.911  -0.274   0.957  1.00  0.00           H  
HETATM   48  H   UNL     1       3.232   1.316  -1.897  1.00  0.00           H  
HETATM   49  H   UNL     1       3.530  -0.216  -1.040  1.00  0.00           H  
HETATM   50  H   UNL     1       1.107   0.450  -1.923  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.440   1.204   0.598  1.00  0.00           H  
HETATM   52  H   UNL     1       1.925   3.774   0.664  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.136   6.001  -0.206  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.364   0.624  -2.253  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.501   3.163  -1.821  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.448   3.937  -2.031  1.00  0.00           H  
HETATM   57  H   UNL     1       0.652  -1.041   0.701  1.00  0.00           H  
HETATM   58  H   UNL     1       1.736  -4.354   0.479  1.00  0.00           H  
HETATM   59  H   UNL     1       4.789  -3.580   0.269  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.272  -1.621  -2.150  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.576  -6.418  -1.346  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.637  -4.191  -2.216  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.539  -1.289  -1.201  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.665   0.137   0.746  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.783  -1.638   0.696  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.455  -2.963   2.706  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.591  -3.025   5.163  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.527  -0.928   6.453  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.327   1.230   5.284  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.182   1.291   2.827  1.00  0.00           H  
CONECT    1    2    2    6   43                                       
CONECT    2    3    1    1   44                                       
CONECT    3    4    4    2   45                                       
CONECT    4    3    3    5   46                                       
CONECT    5    4    6    6   47                                       
CONECT    6    5    5    1    7                                       
CONECT    7    6    8   48   49                                       
CONECT    8    7    9                                                 
CONECT    9    8   22   10   50                                       
CONECT   10    9   11   16   51                                       
CONECT   11   10   12                                                 
CONECT   12   13   13   11   14                                       
CONECT   12   15                                                      
CONECT   13   12   12                                                 
CONECT   14   12   52                                                 
CONECT   15   12   53                                                 
CONECT   16   10   34   17   54                                       
CONECT   17   16   18                                                 
CONECT   18   17   21   21   20                                       
CONECT   18   19                                                      
CONECT   19   18   55                                                 
CONECT   20   18   56                                                 
CONECT   21   18   18                                                 
CONECT   22   23    9   28   57                                       
CONECT   23   24   22                                                 
CONECT   24   25   25   27   26                                       
CONECT   24   23                                                      
CONECT   25   24   24                                                 
CONECT   26   24   58                                                 
CONECT   27   24   59                                                 
CONECT   28   22   29   34   60                                       
CONECT   29   30   28                                                 
CONECT   30   33   33   31   29                                       
CONECT   30   32                                                      
CONECT   31   30   61                                                 
CONECT   32   30   62                                                 
CONECT   33   30   30                                                 
CONECT   34   28   35   16   63                                       
CONECT   35   34   36                                                 
CONECT   36   35   37   64   65                                       
CONECT   37   38   36   42   42                                       
CONECT   38   39   39   37   66                                       
CONECT   39   38   38   40   67                                       
CONECT   40   39   41   41   68                                       
CONECT   41   40   40   42   69                                       
CONECT   42   37   37   41   70                                       
CONECT   43    1                                                      
CONECT   44    2                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   22                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   34                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
CONECT   66   38                                                      
CONECT   67   39                                                      
CONECT   68   40                                                      
CONECT   69   41                                                      
CONECT   70   42                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
