COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.894  -0.310   2.606  1.00  0.00           N  
HETATM    2  N   UNL     1       1.649   1.100  -0.394  1.00  0.00           N  
HETATM    3  C   UNL     1      -6.580  -0.093   1.478  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.904   0.351   0.315  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.625   0.578  -0.867  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.596  -0.123   2.670  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.864   0.311   1.572  1.00  0.00           C  
HETATM    8  C   UNL     1     -10.618  -0.717   1.423  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.824   2.271  -0.472  1.00  0.00           C  
HETATM   10  C   UNL     1       0.257   1.092  -0.472  1.00  0.00           C  
HETATM   11  C   UNL     1       2.329  -0.064  -0.361  1.00  0.00           C  
HETATM   12  C   UNL     1       4.647   1.122  -0.037  1.00  0.00           C  
HETATM   13  C   UNL     1       7.081  -1.585   0.171  1.00  0.00           C  
HETATM   14  C   UNL     1       7.045   1.468   0.273  1.00  0.00           C  
HETATM   15  C   UNL     1       9.064   1.984   1.460  1.00  0.00           C  
HETATM   16  C   UNL     1       8.403   3.320  -0.417  1.00  0.00           C  
HETATM   17  C   UNL     1       4.200  -2.582  -0.234  1.00  0.00           C  
HETATM   18  O   UNL     1      -9.989  -0.269   0.221  1.00  0.00           O  
HETATM   19  C   UNL     1      -8.646  -0.068   0.265  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.968  -0.298   1.427  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.974   0.370  -0.886  1.00  0.00           C  
HETATM   22  O   UNL     1      -8.673   0.590  -2.031  1.00  0.00           O  
HETATM   23  C   UNL     1      -7.932   1.037  -3.168  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.507   0.555   0.372  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.818   0.979  -0.716  1.00  0.00           O  
HETATM   26  C   UNL     1      -2.463   1.044  -0.628  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.443   2.290  -0.393  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.700  -0.112  -0.694  1.00  0.00           C  
HETATM   29  N   UNL     1      -0.385  -0.058  -0.610  1.00  0.00           N  
HETATM   30  O   UNL     1       1.734  -1.119  -0.478  1.00  0.00           O  
HETATM   31  C   UNL     1       3.784  -0.058  -0.185  1.00  0.00           C  
HETATM   32  O   UNL     1       4.290   2.285  -0.037  1.00  0.00           O  
HETATM   33  N   UNL     1       5.909   0.669   0.104  1.00  0.00           N  
HETATM   34  C   UNL     1       7.943   1.193   1.296  1.00  0.00           C  
HETATM   35  C   UNL     1       9.292   3.048   0.607  1.00  0.00           C  
HETATM   36  C   UNL     1       7.280   2.534  -0.586  1.00  0.00           C  
HETATM   37  N   UNL     1       5.899  -0.728   0.054  1.00  0.00           N  
HETATM   38  C   UNL     1       4.622  -1.171  -0.125  1.00  0.00           C  
HETATM   39  C   UNL     1       4.832  -3.456  -1.128  1.00  0.00           C  
HETATM   40  C   UNL     1       4.405  -4.767  -1.195  1.00  0.00           C  
HETATM   41  N   UNL     1       3.419  -5.199  -0.435  1.00  0.00           N  
HETATM   42  C   UNL     1       2.797  -4.411   0.420  1.00  0.00           C  
HETATM   43  C   UNL     1       3.161  -3.086   0.558  1.00  0.00           C  
HETATM   44  H   UNL     1       2.129   1.942  -0.363  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.116   0.917  -1.757  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.084  -0.311   3.602  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.797   0.456   1.656  1.00  0.00           H  
HETATM   48  H   UNL     1     -11.687  -0.836   1.252  1.00  0.00           H  
HETATM   49  H   UNL     1     -10.189  -1.673   1.723  1.00  0.00           H  
HETATM   50  H   UNL     1     -10.457   0.018   2.213  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.393   3.187  -0.418  1.00  0.00           H  
HETATM   52  H   UNL     1       7.975  -0.965   0.228  1.00  0.00           H  
HETATM   53  H   UNL     1       7.002  -2.191   1.074  1.00  0.00           H  
HETATM   54  H   UNL     1       7.145  -2.237  -0.700  1.00  0.00           H  
HETATM   55  H   UNL     1       9.762   1.771   2.256  1.00  0.00           H  
HETATM   56  H   UNL     1       8.586   4.149  -1.084  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.498  -0.636   2.305  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.445   1.984  -2.935  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.177   0.294  -3.424  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.608   1.174  -4.012  1.00  0.00           H  
HETATM   61  H   UNL     1       0.085   3.225  -0.272  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.188  -1.067  -0.814  1.00  0.00           H  
HETATM   63  H   UNL     1       7.765   0.363   1.964  1.00  0.00           H  
HETATM   64  H   UNL     1      10.169   3.664   0.737  1.00  0.00           H  
HETATM   65  H   UNL     1       6.586   2.747  -1.385  1.00  0.00           H  
HETATM   66  H   UNL     1       5.641  -3.109  -1.754  1.00  0.00           H  
HETATM   67  H   UNL     1       4.886  -5.449  -1.881  1.00  0.00           H  
HETATM   68  H   UNL     1       1.996  -4.809   1.026  1.00  0.00           H  
HETATM   69  H   UNL     1       2.647  -2.446   1.260  1.00  0.00           H  
CONECT    1    6    6    3                                            
CONECT    2   11   10   44                                            
CONECT    3    4    1   20   20                                       
CONECT    4   24    5    5    3                                       
CONECT    5    4    4   21   45                                       
CONECT    6    7    1    1   46                                       
CONECT    7   24   24    6   47                                       
CONECT    8   18   48   49   50                                       
CONECT    9   27   26   26   51                                       
CONECT   10    2   27   27   29                                       
CONECT   11   31   30   30    2                                       
CONECT   12   33   31   32   32                                       
CONECT   13   37   52   53   54                                       
CONECT   14   36   36   34   33                                       
CONECT   15   35   34   34   55                                       
CONECT   16   35   35   36   56                                       
CONECT   17   43   38   39   39                                       
CONECT   18   19    8                                                 
CONECT   19   21   21   20   18                                       
CONECT   20    3    3   19   57                                       
CONECT   21    5   22   19   19                                       
CONECT   22   23   21                                                 
CONECT   23   22   58   59   60                                       
CONECT   24   25    7    7    4                                       
CONECT   25   26   24                                                 
CONECT   26   28    9    9   25                                       
CONECT   27   10   10    9   61                                       
CONECT   28   29   29   26   62                                       
CONECT   29   10   28   28                                            
CONECT   30   11   11                                                 
CONECT   31   38   38   12   11                                       
CONECT   32   12   12                                                 
CONECT   33   14   37   12                                            
CONECT   34   15   15   14   63                                       
CONECT   35   16   16   15   64                                       
CONECT   36   16   14   14   65                                       
CONECT   37   13   33   38                                            
CONECT   38   37   17   31   31                                       
CONECT   39   17   17   40   66                                       
CONECT   40   41   41   39   67                                       
CONECT   41   42   40   40                                            
CONECT   42   43   43   41   68                                       
CONECT   43   42   42   17   69                                       
CONECT   44    2                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   13                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   20                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   34                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   39                                                      
CONECT   67   40                                                      
CONECT   68   42                                                      
CONECT   69   43                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
