COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.043   0.980   0.095  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.608  -0.644   0.142  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.967   0.047   0.296  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.238   0.629   0.158  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.221  -0.527   0.962  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.311   0.547   0.998  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.940  -0.994   0.207  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.754   1.911  -0.387  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.440   1.579  -1.015  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.325   0.536  -1.110  1.00  0.00           C  
HETATM   11  C   UNL     1       0.400  -1.636   0.067  1.00  0.00           C  
HETATM   12  N   UNL     1      -5.617   0.981  -0.371  1.00  0.00           N  
HETATM   13  C   UNL     1       0.092  -3.002   0.055  1.00  0.00           C  
HETATM   14  C   UNL     1       1.099  -3.921  -0.029  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.584  -5.601   0.038  1.00  0.00           C  
HETATM   16  N   UNL     1       1.363   2.327   0.116  1.00  0.00           N  
HETATM   17  C   UNL     1       0.300   3.331   0.206  1.00  0.00           C  
HETATM   18  C   UNL     1       2.764   2.747   0.049  1.00  0.00           C  
HETATM   19  C   UNL     1       2.976   3.621  -1.190  1.00  0.00           C  
HETATM   20  C   UNL     1       4.439   4.060  -1.260  1.00  0.00           C  
HETATM   21  C   UNL     1       4.793   4.861  -0.005  1.00  0.00           C  
HETATM   22  C   UNL     1       4.582   3.987   1.233  1.00  0.00           C  
HETATM   23  C   UNL     1       3.118   3.548   1.304  1.00  0.00           C  
HETATM   24  N   UNL     1       2.021   0.099   0.019  1.00  0.00           N  
HETATM   25  C   UNL     1       1.751  -1.216   0.002  1.00  0.00           C  
HETATM   26  C   UNL     1       2.767  -2.176  -0.079  1.00  0.00           C  
HETATM   27  O   UNL     1       0.798  -5.248  -0.040  1.00  0.00           O  
HETATM   28  C   UNL     1       2.438  -3.513  -0.094  1.00  0.00           C  
HETATM   29  O   UNL     1       3.422  -4.447  -0.172  1.00  0.00           O  
HETATM   30  C   UNL     1       4.767  -3.969  -0.235  1.00  0.00           C  
HETATM   31  H   UNL     1      -2.591   0.881   0.887  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.576  -1.386   0.391  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.983  -0.838   1.979  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.210   0.137   1.458  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.961   1.400   1.579  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.197  -1.929   0.195  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.556   2.739   0.294  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.895   2.296  -1.397  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.095   2.427  -0.423  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.707   1.919  -2.015  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.446   0.984  -1.574  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.665  -0.306  -1.713  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.937  -3.327   0.105  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.007  -5.213   0.965  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.117  -5.173  -0.811  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.684  -6.686   0.020  1.00  0.00           H  
HETATM   47  H   UNL     1       0.095   3.550   1.254  1.00  0.00           H  
HETATM   48  H   UNL     1       0.618   4.242  -0.301  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.603   2.948  -0.269  1.00  0.00           H  
HETATM   50  H   UNL     1       3.405   1.868  -0.014  1.00  0.00           H  
HETATM   51  H   UNL     1       2.724   3.050  -2.084  1.00  0.00           H  
HETATM   52  H   UNL     1       2.335   4.500  -1.128  1.00  0.00           H  
HETATM   53  H   UNL     1       5.080   3.181  -1.323  1.00  0.00           H  
HETATM   54  H   UNL     1       4.590   4.682  -2.143  1.00  0.00           H  
HETATM   55  H   UNL     1       5.836   5.174  -0.056  1.00  0.00           H  
HETATM   56  H   UNL     1       4.152   5.740   0.057  1.00  0.00           H  
HETATM   57  H   UNL     1       5.222   3.108   1.171  1.00  0.00           H  
HETATM   58  H   UNL     1       4.833   4.558   2.127  1.00  0.00           H  
HETATM   59  H   UNL     1       2.477   4.427   1.366  1.00  0.00           H  
HETATM   60  H   UNL     1       2.967   2.926   2.186  1.00  0.00           H  
HETATM   61  H   UNL     1       3.802  -1.870  -0.129  1.00  0.00           H  
HETATM   62  H   UNL     1       4.888  -3.341  -1.118  1.00  0.00           H  
HETATM   63  H   UNL     1       4.987  -3.385   0.659  1.00  0.00           H  
HETATM   64  H   UNL     1       5.451  -4.815  -0.294  1.00  0.00           H  
HETATM   65  C   UNL     1      -8.020   1.176   0.059  1.00  0.00           C  
HETATM   66  H   UNL     1      -7.879   0.790   1.069  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.864   1.866   0.048  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.218   0.348  -0.621  1.00  0.00           H  
CONECT    1   24   16    4    4                                       
CONECT    2    4   11   11    7                                       
CONECT    3   10    7    5   31                                       
CONECT    4    1    1    2                                            
CONECT    5    3    6   32   33                                       
CONECT    6   12    5   34   35                                       
CONECT    7    2    3   36                                            
CONECT    8   12   37   38   65                                       
CONECT    9   10   12   39   40                                       
CONECT   10    9    3   41   42                                       
CONECT   11   25   13    2    2                                       
CONECT   12    9    8    6                                            
CONECT   13   14   14   11   43                                       
CONECT   14   28   27   13   13                                       
CONECT   15   27   44   45   46                                       
CONECT   16   18    1   17                                            
CONECT   17   16   47   48   49                                       
CONECT   18   19   16   23   50                                       
CONECT   19   20   18   51   52                                       
CONECT   20   21   19   53   54                                       
CONECT   21   20   22   55   56                                       
CONECT   22   21   23   57   58                                       
CONECT   23   18   22   59   60                                       
CONECT   24   25   25    1                                            
CONECT   25   26   24   24   11                                       
CONECT   26   28   28   25   61                                       
CONECT   27   14   15                                                 
CONECT   28   29   26   26   14                                       
CONECT   29   30   28                                                 
CONECT   30   29   62   63   64                                       
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   26                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65    8   66   67   68                                       
CONECT   66   65                                                      
CONECT   67   65                                                      
CONECT   68   65                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
