COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.930   2.727   0.423  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.381   1.328   0.310  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.222   0.284   0.104  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.678   0.518  -0.010  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.338   0.257  -1.212  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.694   0.477  -1.314  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.406   0.957  -0.222  1.00  0.00           C  
HETATM    8  O   UNL     1      -6.743   1.172  -0.326  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.754   1.217   0.976  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.398   0.995   1.087  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.683  -1.089  -0.008  1.00  0.00           C  
HETATM   12  C   UNL     1       0.155  -1.428  -1.072  1.00  0.00           C  
HETATM   13  C   UNL     1       0.655  -2.708  -1.173  1.00  0.00           C  
HETATM   14  C   UNL     1       0.327  -3.661  -0.217  1.00  0.00           C  
HETATM   15  O   UNL     1       0.821  -4.922  -0.320  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.506  -3.328   0.844  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.006  -2.048   0.954  1.00  0.00           C  
HETATM   18  C   UNL     1       1.066   1.095   0.422  1.00  0.00           C  
HETATM   19  C   UNL     1       1.572   0.342   1.501  1.00  0.00           C  
HETATM   20  C   UNL     1       2.903   0.115   1.625  1.00  0.00           C  
HETATM   21  C   UNL     1       3.799   0.633   0.671  1.00  0.00           C  
HETATM   22  C   UNL     1       5.181   0.409   0.781  1.00  0.00           C  
HETATM   23  C   UNL     1       6.025   0.922  -0.157  1.00  0.00           C  
HETATM   24  C   UNL     1       5.539   1.669  -1.228  1.00  0.00           C  
HETATM   25  C   UNL     1       4.206   1.907  -1.368  1.00  0.00           C  
HETATM   26  C   UNL     1       3.304   1.393  -0.419  1.00  0.00           C  
HETATM   27  C   UNL     1       1.924   1.614  -0.538  1.00  0.00           C  
HETATM   28  H   UNL     1      -0.964   3.185  -0.565  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.936   2.689   0.841  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.288   3.318   1.076  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.785  -0.116  -2.062  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.205   0.276  -2.244  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.284   0.405  -0.092  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.310   1.590   1.823  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.891   1.197   2.020  1.00  0.00           H  
HETATM   36  H   UNL     1       0.410  -0.688  -1.816  1.00  0.00           H  
HETATM   37  H   UNL     1       1.303  -2.971  -1.996  1.00  0.00           H  
HETATM   38  H   UNL     1       1.668  -5.050   0.129  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.759  -4.071   1.585  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.650  -1.789   1.781  1.00  0.00           H  
HETATM   41  H   UNL     1       0.891  -0.058   2.237  1.00  0.00           H  
HETATM   42  H   UNL     1       3.276  -0.464   2.457  1.00  0.00           H  
HETATM   43  H   UNL     1       5.573  -0.167   1.606  1.00  0.00           H  
HETATM   44  H   UNL     1       7.087   0.748  -0.069  1.00  0.00           H  
HETATM   45  H   UNL     1       6.230   2.065  -1.957  1.00  0.00           H  
HETATM   46  H   UNL     1       3.843   2.488  -2.203  1.00  0.00           H  
HETATM   47  H   UNL     1       1.533   2.187  -1.365  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    3    3    1   18                                       
CONECT    3    4   11    2    2                                       
CONECT    4   10   10    5    3                                       
CONECT    5    6    6    4   31                                       
CONECT    6    7    5    5   32                                       
CONECT    7    8    9    9    6                                       
CONECT    8    7   33                                                 
CONECT    9    7    7   10   34                                       
CONECT   10    9    4    4   35                                       
CONECT   11    3   12   12   17                                       
CONECT   12   11   11   13   36                                       
CONECT   13   12   14   14   37                                       
CONECT   14   13   13   16   15                                       
CONECT   15   14   38                                                 
CONECT   16   17   17   14   39                                       
CONECT   17   11   16   16   40                                       
CONECT   18    2   27   27   19                                       
CONECT   19   18   20   20   41                                       
CONECT   20   19   19   21   42                                       
CONECT   21   26   20   22   22                                       
CONECT   22   21   21   23   43                                       
CONECT   23   24   24   22   44                                       
CONECT   24   25   23   23   45                                       
CONECT   25   26   26   24   46                                       
CONECT   26   27   25   25   21                                       
CONECT   27   18   18   26   47                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
