COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.756  -2.007   0.414  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.269  -2.163   0.580  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.827  -0.953   1.332  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.530   0.322   0.540  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.017   0.478   0.374  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.459  -0.732  -0.378  1.00  0.00           C  
HETATM    7  N   UNL     1      -5.006  -0.583  -0.537  1.00  0.00           N  
HETATM    8  C   UNL     1      -4.343  -0.463   0.769  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.828  -0.389   0.564  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.686   0.567  -1.394  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.171   0.641  -1.599  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.508   0.760  -0.293  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.133   0.902  -0.444  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.406  -0.086  -1.080  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.489   2.054   0.049  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.224   3.045   0.682  1.00  0.00           N  
HETATM   17  C   UNL     1       0.890   2.194  -0.104  1.00  0.00           C  
HETATM   18  C   UNL     1       1.582   3.390   0.405  1.00  0.00           C  
HETATM   19  O   UNL     1       0.949   4.374   0.736  1.00  0.00           O  
HETATM   20  C   UNL     1       3.057   3.380   0.507  1.00  0.00           C  
HETATM   21  C   UNL     1       3.724   4.359   1.236  1.00  0.00           C  
HETATM   22  C   UNL     1       5.105   4.333   1.320  1.00  0.00           C  
HETATM   23  C   UNL     1       5.828   3.340   0.685  1.00  0.00           C  
HETATM   24  C   UNL     1       5.180   2.358  -0.044  1.00  0.00           C  
HETATM   25  C   UNL     1       3.793   2.369  -0.139  1.00  0.00           C  
HETATM   26  C   UNL     1       3.083   1.327  -0.912  1.00  0.00           C  
HETATM   27  O   UNL     1       3.695   0.600  -1.673  1.00  0.00           O  
HETATM   28  C   UNL     1       1.631   1.178  -0.752  1.00  0.00           C  
HETATM   29  C   UNL     1       0.973   0.042  -1.240  1.00  0.00           C  
HETATM   30  N   UNL     1       1.693  -0.956  -1.880  1.00  0.00           N  
HETATM   31  C   UNL     1       2.420  -1.878  -1.134  1.00  0.00           C  
HETATM   32  C   UNL     1       2.319  -1.880   0.255  1.00  0.00           C  
HETATM   33  C   UNL     1       3.030  -2.791   0.993  1.00  0.00           C  
HETATM   34  C   UNL     1       3.856  -3.718   0.350  1.00  0.00           C  
HETATM   35  C   UNL     1       4.622  -4.699   1.141  1.00  0.00           C  
HETATM   36  O   UNL     1       4.535  -4.703   2.353  1.00  0.00           O  
HETATM   37  O   UNL     1       5.418  -5.591   0.520  1.00  0.00           O  
HETATM   38  C   UNL     1       3.955  -3.713  -1.045  1.00  0.00           C  
HETATM   39  C   UNL     1       3.242  -2.799  -1.777  1.00  0.00           C  
HETATM   40  H   UNL     1      -6.288  -1.942   1.397  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.359  -2.869  -0.121  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.738  -2.228  -0.402  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.481  -3.071   1.144  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.905  -1.064   1.450  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.359  -0.888   2.314  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.998   0.257  -0.442  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.927   1.184   1.076  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.805   1.386  -0.190  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.549   0.543   1.357  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.927  -0.797  -1.360  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.686   0.442   1.270  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.585  -1.332   1.381  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.336  -0.272   1.529  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.480  -1.306   0.088  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.178   0.449  -2.359  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.034   1.484  -0.918  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.827  -0.264  -2.100  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.929   1.510  -2.211  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.910  -0.963  -1.457  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.778   3.685   1.259  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.183   3.097   0.549  1.00  0.00           H  
HETATM   62  H   UNL     1       3.165   5.138   1.734  1.00  0.00           H  
HETATM   63  H   UNL     1       5.622   5.094   1.886  1.00  0.00           H  
HETATM   64  H   UNL     1       6.905   3.331   0.758  1.00  0.00           H  
HETATM   65  H   UNL     1       5.751   1.585  -0.538  1.00  0.00           H  
HETATM   66  H   UNL     1       1.690  -1.011  -2.849  1.00  0.00           H  
HETATM   67  H   UNL     1       1.681  -1.164   0.751  1.00  0.00           H  
HETATM   68  H   UNL     1       2.952  -2.793   2.071  1.00  0.00           H  
HETATM   69  H   UNL     1       5.900  -6.214   1.080  1.00  0.00           H  
HETATM   70  H   UNL     1       4.593  -4.427  -1.544  1.00  0.00           H  
HETATM   71  H   UNL     1       3.314  -2.797  -2.855  1.00  0.00           H  
CONECT    1    2    6   40   41                                       
CONECT    2    1    3   42   43                                       
CONECT    3    2    4   44   45                                       
CONECT    4    3    5   46   47                                       
CONECT    5    6    4   48   49                                       
CONECT    6    7    1    5   50                                       
CONECT    7   10    8    6                                            
CONECT    8    7    9   51   52                                       
CONECT    9   12    8   53   54                                       
CONECT   10   11    7   55   56                                       
CONECT   11   12   10   57   58                                       
CONECT   12   11   13    9                                            
CONECT   13   14   12   15   15                                       
CONECT   14   29   29   13   59                                       
CONECT   15   13   13   17   16                                       
CONECT   16   15   60   61                                            
CONECT   17   28   28   15   18                                       
CONECT   18   17   20   19   19                                       
CONECT   19   18   18                                                 
CONECT   20   25   18   21   21                                       
CONECT   21   20   20   22   62                                       
CONECT   22   23   23   21   63                                       
CONECT   23   24   22   22   64                                       
CONECT   24   25   25   23   65                                       
CONECT   25   26   24   24   20                                       
CONECT   26   27   27   28   25                                       
CONECT   27   26   26                                                 
CONECT   28   29   26   17   17                                       
CONECT   29   30   14   14   28                                       
CONECT   30   31   29   66                                            
CONECT   31   32   32   39   30                                       
CONECT   32   33   31   31   67                                       
CONECT   33   34   34   32   68                                       
CONECT   34   35   33   33   38                                       
CONECT   35   36   36   37   34                                       
CONECT   36   35   35                                                 
CONECT   37   35   69                                                 
CONECT   38   34   39   39   70                                       
CONECT   39   38   38   31   71                                       
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    2                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    4                                                      
CONECT   47    4                                                      
CONECT   48    5                                                      
CONECT   49    5                                                      
CONECT   50    6                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54    9                                                      
CONECT   55   10                                                      
CONECT   56   10                                                      
CONECT   57   11                                                      
CONECT   58   11                                                      
CONECT   59   14                                                      
CONECT   60   16                                                      
CONECT   61   16                                                      
CONECT   62   21                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   30                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
CONECT   71   39                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
