COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.394   2.823  -0.228  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.713   3.087  -0.620  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.110   4.424  -0.801  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.214   5.387  -0.592  1.00  0.00           N  
HETATM    5  N   UNL     1       0.428   3.853  -0.043  1.00  0.00           N  
HETATM    6  C   UNL     1       0.015   5.094  -0.225  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.888   3.125  -1.247  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.893   2.266  -0.918  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.979   0.786  -0.870  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.018   0.170  -0.175  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.095  -1.212  -0.133  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.134  -1.983  -0.784  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.100  -1.368  -1.474  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.023   0.009  -1.524  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.745  -1.194   1.584  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.806  -1.897   2.391  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.328  -0.955   3.477  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.191  -4.068  -1.432  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.441  -5.569  -1.274  1.00  0.00           C  
HETATM   20  C   UNL     1       1.742   0.230   1.101  1.00  0.00           C  
HETATM   21  C   UNL     1       4.057   0.746   0.812  1.00  0.00           C  
HETATM   22  C   UNL     1       3.715   1.796  -0.061  1.00  0.00           C  
HETATM   23  C   UNL     1       4.972   2.404  -0.485  1.00  0.00           C  
HETATM   24  C   UNL     1       6.221  -0.198   1.701  1.00  0.00           C  
HETATM   25  C   UNL     1       6.555  -1.414   0.875  1.00  0.00           C  
HETATM   26  C   UNL     1       7.713  -1.440   0.120  1.00  0.00           C  
HETATM   27  C   UNL     1       8.019  -2.555  -0.638  1.00  0.00           C  
HETATM   28  C   UNL     1       7.168  -3.644  -0.641  1.00  0.00           C  
HETATM   29  C   UNL     1       6.010  -3.618   0.114  1.00  0.00           C  
HETATM   30  C   UNL     1       5.707  -2.505   0.877  1.00  0.00           C  
HETATM   31  C   UNL     1       1.391   1.272   0.242  1.00  0.00           C  
HETATM   32  C   UNL     1       3.052  -0.029   1.385  1.00  0.00           C  
HETATM   33  C   UNL     1       2.368   2.055  -0.340  1.00  0.00           C  
HETATM   34  N   UNL     1      -5.138  -1.835   0.565  1.00  0.00           N  
HETATM   35  N   UNL     1       0.041   1.524  -0.032  1.00  0.00           N  
HETATM   36  N   UNL     1       5.427   0.735   0.898  1.00  0.00           N  
HETATM   37  N   UNL     1       5.943   1.757   0.095  1.00  0.00           N  
HETATM   38  N   UNL     1      -3.425   4.412  -1.179  1.00  0.00           N  
HETATM   39  O   UNL     1      -5.437  -0.052   1.851  1.00  0.00           O  
HETATM   40  O   UNL     1      -3.209  -3.340  -0.742  1.00  0.00           O  
HETATM   41  O   UNL     1      -3.663  -5.919  -1.926  1.00  0.00           O  
HETATM   42  H   UNL     1       0.715   5.901  -0.065  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.892   2.839  -1.522  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.762   0.769   0.329  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.359  -1.967  -1.981  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.217   0.486  -2.062  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.627  -2.188   1.736  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.379  -2.786   2.856  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.096  -1.463   4.061  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.507  -0.664   4.132  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.755  -0.066   3.012  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.217  -3.815  -1.013  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.210  -3.806  -2.490  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.617  -6.124  -1.723  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.510  -5.816  -0.214  1.00  0.00           H  
HETATM   56  H   UNL     1       0.969  -0.375   1.550  1.00  0.00           H  
HETATM   57  H   UNL     1       5.078   3.240  -1.159  1.00  0.00           H  
HETATM   58  H   UNL     1       5.649  -0.501   2.578  1.00  0.00           H  
HETATM   59  H   UNL     1       7.143   0.289   2.019  1.00  0.00           H  
HETATM   60  H   UNL     1       8.378  -0.589   0.122  1.00  0.00           H  
HETATM   61  H   UNL     1       8.923  -2.575  -1.228  1.00  0.00           H  
HETATM   62  H   UNL     1       7.407  -4.514  -1.233  1.00  0.00           H  
HETATM   63  H   UNL     1       5.345  -4.468   0.112  1.00  0.00           H  
HETATM   64  H   UNL     1       4.804  -2.486   1.470  1.00  0.00           H  
HETATM   65  H   UNL     1       3.309  -0.836   2.056  1.00  0.00           H  
HETATM   66  H   UNL     1       2.096   2.859  -1.008  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.424  -2.728   0.315  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.589   0.788  -0.085  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.954   5.202  -1.370  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.885  -6.859  -1.866  1.00  0.00           H  
CONECT    1   35    2    2    5                                       
CONECT    2    8    1    1    3                                       
CONECT    3    2   38    4    4                                       
CONECT    4    3    3    6                                            
CONECT    5    1    6    6                                            
CONECT    6    5    5    4   42                                       
CONECT    7    8    8   38   43                                       
CONECT    8    9    2    7    7                                       
CONECT    9   14    8   10   10                                       
CONECT   10    9    9   11   44                                       
CONECT   11   12   12   10   34                                       
CONECT   12   13   40   11   11                                       
CONECT   13   14   14   12   45                                       
CONECT   14   13   13    9   46                                       
CONECT   15   34   39   39   16                                       
CONECT   16   15   17   47   48                                       
CONECT   17   16   49   50   51                                       
CONECT   18   40   19   52   53                                       
CONECT   19   18   41   54   55                                       
CONECT   20   31   31   32   56                                       
CONECT   21   22   36   32   32                                       
CONECT   22   23   33   33   21                                       
CONECT   23   37   37   22   57                                       
CONECT   24   36   25   58   59                                       
CONECT   25   24   30   30   26                                       
CONECT   26   25   27   27   60                                       
CONECT   27   26   26   28   61                                       
CONECT   28   29   29   27   62                                       
CONECT   29   30   28   28   63                                       
CONECT   30   25   25   29   64                                       
CONECT   31   33   35   20   20                                       
CONECT   32   21   21   20   65                                       
CONECT   33   22   22   31   66                                       
CONECT   34   11   15   67                                            
CONECT   35   31    1   68                                            
CONECT   36   37   21   24                                            
CONECT   37   23   23   36                                            
CONECT   38    7    3   69                                            
CONECT   39   15   15                                                 
CONECT   40   18   12                                                 
CONECT   41   19   70                                                 
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44   10                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   34                                                      
CONECT   68   35                                                      
CONECT   69   38                                                      
CONECT   70   41                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
