COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.938  -3.795  -1.204  1.00  0.00           C  
HETATM    2  C   UNL     1       1.402  -3.651   0.222  1.00  0.00           C  
HETATM    3  C   UNL     1       2.859  -3.175   0.351  1.00  0.00           C  
HETATM    4  C   UNL     1       2.386  -2.296   1.521  1.00  0.00           C  
HETATM    5  C   UNL     1       0.992  -2.318   0.871  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.806   0.440  -0.179  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.878   1.043  -0.997  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.299   1.876  -2.025  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.642   2.115  -2.231  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.579   1.519  -1.408  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.340  -0.358   1.163  1.00  0.00           C  
HETATM   12  C   UNL     1       0.237   2.123  -0.281  1.00  0.00           C  
HETATM   13  C   UNL     1       3.932   1.737  -0.231  1.00  0.00           C  
HETATM   14  C   UNL     1       5.255   1.739  -0.641  1.00  0.00           C  
HETATM   15  C   UNL     1       6.248   1.345   0.243  1.00  0.00           C  
HETATM   16  C   UNL     1       5.926   0.952   1.529  1.00  0.00           C  
HETATM   17  C   UNL     1       4.606   0.945   1.952  1.00  0.00           C  
HETATM   18  C   UNL     1       3.603   1.336   1.079  1.00  0.00           C  
HETATM   19  C   UNL     1       2.133   1.451   1.181  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.333  -4.160  -1.466  1.00  0.00           N  
HETATM   21  O   UNL     1       1.707  -3.578  -2.117  1.00  0.00           O  
HETATM   22  C   UNL     1       0.771  -1.206  -0.121  1.00  0.00           C  
HETATM   23  O   UNL     1       1.427  -1.164  -1.141  1.00  0.00           O  
HETATM   24  N   UNL     1      -0.155  -0.258   0.124  1.00  0.00           N  
HETATM   25  C   UNL     1      -0.967  -0.280   1.352  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.426  -0.486   0.946  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.163   0.681  -0.388  1.00  0.00           C  
HETATM   28  O   UNL     1      -5.085   0.094   0.421  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.459   0.388   0.159  1.00  0.00           C  
HETATM   30  O   UNL     1      -7.091   0.142   2.478  1.00  0.00           O  
HETATM   31  C   UNL     1      -0.394   0.838  -0.821  1.00  0.00           C  
HETATM   32  N   UNL     1       1.655   1.890   0.003  1.00  0.00           N  
HETATM   33  C   UNL     1       2.649   2.077  -0.884  1.00  0.00           C  
HETATM   34  O   UNL     1       2.516   2.461  -2.028  1.00  0.00           O  
HETATM   35  O   UNL     1       1.468   1.192   2.164  1.00  0.00           O  
HETATM   36  H   UNL     1       1.172  -4.524   0.832  1.00  0.00           H  
HETATM   37  H   UNL     1       3.551  -3.963   0.648  1.00  0.00           H  
HETATM   38  H   UNL     1       3.210  -2.605  -0.510  1.00  0.00           H  
HETATM   39  H   UNL     1       2.425  -2.799   2.487  1.00  0.00           H  
HETATM   40  H   UNL     1       2.845  -1.308   1.539  1.00  0.00           H  
HETATM   41  H   UNL     1       0.177  -2.414   1.589  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.568   2.343  -2.669  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.960   2.765  -3.032  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.632   1.702  -1.564  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.389  -0.206   0.909  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.109  -1.423   1.129  1.00  0.00           H  
HETATM   47  H   UNL     1       0.140   2.915  -1.023  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.273   2.421   0.636  1.00  0.00           H  
HETATM   49  H   UNL     1       5.513   2.045  -1.644  1.00  0.00           H  
HETATM   50  H   UNL     1       7.280   1.346  -0.075  1.00  0.00           H  
HETATM   51  H   UNL     1       6.709   0.647   2.208  1.00  0.00           H  
HETATM   52  H   UNL     1       4.361   0.635   2.957  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.633  -4.249  -2.384  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.948  -4.334  -0.736  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.644  -1.099   1.993  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.861   0.667   1.881  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.068  -0.289   1.804  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.566  -1.518   0.623  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.712   0.070  -0.853  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.626   1.460   0.255  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.616  -0.286   3.168  1.00  0.00           H  
HETATM   62  H   UNL     1       0.055   0.591  -1.783  1.00  0.00           H  
CONECT    1   20   21   21    2                                       
CONECT    2    1    5    3   36                                       
CONECT    3    2    4   37   38                                       
CONECT    4    5    3   39   40                                       
CONECT    5   22    2    4   41                                       
CONECT    6   27   26    7    7                                       
CONECT    7    6    6    8   31                                       
CONECT    8    9    9    7   42                                       
CONECT    9   10    8    8   43                                       
CONECT   10   27   27    9   44                                       
CONECT   11   30   29   45   46                                       
CONECT   12   31   32   47   48                                       
CONECT   13   33   18   18   14                                       
CONECT   14   13   15   15   49                                       
CONECT   15   14   14   16   50                                       
CONECT   16   17   17   15   51                                       
CONECT   17   18   16   16   52                                       
CONECT   18   19   13   13   17                                       
CONECT   19   32   35   35   18                                       
CONECT   20    1   53   54                                            
CONECT   21    1    1                                                 
CONECT   22   24    5   23   23                                       
CONECT   23   22   22                                                 
CONECT   24   25   31   22                                            
CONECT   25   26   24   55   56                                       
CONECT   26    6   25   57   58                                       
CONECT   27   28   10   10    6                                       
CONECT   28   29   27                                                 
CONECT   29   11   28   59   60                                       
CONECT   30   11   61                                                 
CONECT   31    7   12   24   62                                       
CONECT   32   12   33   19                                            
CONECT   33   34   34   32   13                                       
CONECT   34   33   33                                                 
CONECT   35   19   19                                                 
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
