COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.500  -0.229  -0.051  1.00  0.00           N  
HETATM    2  C   UNL     1       0.729  -1.007   0.123  1.00  0.00           C  
HETATM    3  C   UNL     1       1.941  -0.079   0.014  1.00  0.00           C  
HETATM    4  O   UNL     1       2.015   0.453  -1.310  1.00  0.00           O  
HETATM    5  C   UNL     1       3.216  -0.867   0.319  1.00  0.00           C  
HETATM    6  N   UNL     1       4.366   0.048   0.331  1.00  0.00           N  
HETATM    7  C   UNL     1       5.551  -0.768   0.628  1.00  0.00           C  
HETATM    8  C   UNL     1       6.773   0.114   0.656  1.00  0.00           C  
HETATM    9  C   UNL     1       7.495   0.332  -0.503  1.00  0.00           C  
HETATM   10  C   UNL     1       8.619   1.135  -0.477  1.00  0.00           C  
HETATM   11  C   UNL     1       9.016   1.730   0.707  1.00  0.00           C  
HETATM   12  C   UNL     1       8.292   1.515   1.865  1.00  0.00           C  
HETATM   13  C   UNL     1       7.170   0.707   1.839  1.00  0.00           C  
HETATM   14  C   UNL     1       9.408   1.369  -1.739  1.00  0.00           C  
HETATM   15  C   UNL     1       0.810  -2.082  -0.962  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.315  -3.068  -0.779  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.529  -2.855  -1.405  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.561  -3.759  -1.236  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.379  -4.876  -0.442  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.165  -5.089   0.183  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.131  -4.187   0.011  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.657  -0.670   0.481  1.00  0.00           C  
HETATM   23  O   UNL     1      -1.700  -1.751   1.029  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.870   0.162   0.396  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.990  -0.350   0.800  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.271   0.368   0.774  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.583   1.159  -0.222  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.878   1.874  -0.207  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.716   1.711   0.791  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.366   0.813   1.905  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.214   0.181   1.895  1.00  0.00           C  
HETATM   32  O   UNL     1      -4.761   1.341  -1.278  1.00  0.00           O  
HETATM   33  C   UNL     1      -3.660   2.034  -0.920  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.738   1.524  -0.137  1.00  0.00           C  
HETATM   35  C   UNL     1      -1.547   2.316   0.217  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.402   3.539  -0.241  1.00  0.00           C  
HETATM   37  C   UNL     1      -2.436   4.119  -1.115  1.00  0.00           C  
HETATM   38  C   UNL     1      -3.496   3.412  -1.433  1.00  0.00           C  
HETATM   39  H   UNL     1      -0.480   0.603  -0.548  1.00  0.00           H  
HETATM   40  H   UNL     1       0.723  -1.482   1.105  1.00  0.00           H  
HETATM   41  H   UNL     1       1.839   0.738   0.728  1.00  0.00           H  
HETATM   42  H   UNL     1       2.104  -0.301  -1.910  1.00  0.00           H  
HETATM   43  H   UNL     1       3.365  -1.628  -0.448  1.00  0.00           H  
HETATM   44  H   UNL     1       3.123  -1.346   1.293  1.00  0.00           H  
HETATM   45  H   UNL     1       4.235   0.667   1.117  1.00  0.00           H  
HETATM   46  H   UNL     1       5.670  -1.530  -0.142  1.00  0.00           H  
HETATM   47  H   UNL     1       5.427  -1.248   1.598  1.00  0.00           H  
HETATM   48  H   UNL     1       7.184  -0.132  -1.428  1.00  0.00           H  
HETATM   49  H   UNL     1       9.892   2.361   0.727  1.00  0.00           H  
HETATM   50  H   UNL     1       8.602   1.979   2.789  1.00  0.00           H  
HETATM   51  H   UNL     1       6.605   0.539   2.744  1.00  0.00           H  
HETATM   52  H   UNL     1      10.183   0.608  -1.829  1.00  0.00           H  
HETATM   53  H   UNL     1       8.742   1.313  -2.600  1.00  0.00           H  
HETATM   54  H   UNL     1       9.870   2.356  -1.701  1.00  0.00           H  
HETATM   55  H   UNL     1       0.727  -1.615  -1.943  1.00  0.00           H  
HETATM   56  H   UNL     1       1.765  -2.603  -0.887  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.671  -1.982  -2.025  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.510  -3.592  -1.724  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.186  -5.581  -0.310  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.023  -5.961   0.804  1.00  0.00           H  
HETATM   61  H   UNL     1       0.818  -4.354   0.500  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.981  -1.362   1.177  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.137   2.533  -1.023  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.660   2.235   0.795  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.054   0.673   2.726  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.955  -0.478   2.711  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.790   1.889   0.859  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.528   4.117   0.021  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.322   5.124  -1.495  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.254   3.840  -2.073  1.00  0.00           H  
CONECT    1    2   22   39                                            
CONECT    2    1    3   15   40                                       
CONECT    3    2    4    5   41                                       
CONECT    4    3   42                                                 
CONECT    5    3    6   43   44                                       
CONECT    6    5    7   45                                            
CONECT    7    6    8   46   47                                       
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   48                                       
CONECT   10    9   11   11   14                                       
CONECT   11   10   10   12   49                                       
CONECT   12   11   13   13   50                                       
CONECT   13    8   12   12   51                                       
CONECT   14   10   52   53   54                                       
CONECT   15    2   16   55   56                                       
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   57                                       
CONECT   18   17   19   19   58                                       
CONECT   19   18   18   20   59                                       
CONECT   20   19   21   21   60                                       
CONECT   21   16   20   20   61                                       
CONECT   22    1   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   25   34                                       
CONECT   25   24   24   26   62                                       
CONECT   26   25   27   27   31                                       
CONECT   27   26   26   28   32                                       
CONECT   28   27   29   29   63                                       
CONECT   29   28   28   30   64                                       
CONECT   30   29   31   31   65                                       
CONECT   31   26   30   30   66                                       
CONECT   32   27   33                                                 
CONECT   33   32   34   34   38                                       
CONECT   34   24   33   33   35                                       
CONECT   35   34   36   36   67                                       
CONECT   36   35   35   37   68                                       
CONECT   37   36   38   38   69                                       
CONECT   38   33   37   37   70                                       
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    9                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   17                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   25                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
