COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.290  -2.381  -1.156  1.00  0.00           C  
HETATM    2  C   UNL     1       4.372  -1.760  -0.135  1.00  0.00           C  
HETATM    3  C   UNL     1       4.318  -2.277   1.147  1.00  0.00           C  
HETATM    4  C   UNL     1       3.479  -1.718   2.095  1.00  0.00           C  
HETATM    5  C   UNL     1       2.688  -0.639   1.765  1.00  0.00           C  
HETATM    6  C   UNL     1       2.737  -0.113   0.469  1.00  0.00           C  
HETATM    7  C   UNL     1       3.592  -0.673  -0.483  1.00  0.00           C  
HETATM    8  C   UNL     1       3.681  -0.125  -1.881  1.00  0.00           C  
HETATM    9  C   UNL     1       2.418   0.646  -2.255  1.00  0.00           C  
HETATM   10  C   UNL     1       2.154   1.731  -1.203  1.00  0.00           C  
HETATM   11  C   UNL     1       1.888   1.038   0.115  1.00  0.00           C  
HETATM   12  C   UNL     1       0.892   1.451   0.936  1.00  0.00           C  
HETATM   13  C   UNL     1       0.177   2.628   0.640  1.00  0.00           C  
HETATM   14  C   UNL     1       0.878   3.962   0.669  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.147   2.561   0.326  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.800   1.318   0.299  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.126   1.251  -0.015  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.779   0.009  -0.043  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.014  -1.251   0.274  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.104  -0.059  -0.356  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.798  -1.279  -0.225  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.233  -2.254   0.235  1.00  0.00           O  
HETATM   23  O   UNL     1      -7.090  -1.365  -0.609  1.00  0.00           O  
HETATM   24  H   UNL     1       4.759  -3.169  -1.690  1.00  0.00           H  
HETATM   25  H   UNL     1       5.617  -1.618  -1.862  1.00  0.00           H  
HETATM   26  H   UNL     1       6.159  -2.806  -0.652  1.00  0.00           H  
HETATM   27  H   UNL     1       4.936  -3.124   1.409  1.00  0.00           H  
HETATM   28  H   UNL     1       3.444  -2.128   3.094  1.00  0.00           H  
HETATM   29  H   UNL     1       2.032  -0.201   2.503  1.00  0.00           H  
HETATM   30  H   UNL     1       4.540   0.543  -1.949  1.00  0.00           H  
HETATM   31  H   UNL     1       3.814  -0.951  -2.580  1.00  0.00           H  
HETATM   32  H   UNL     1       2.551   1.110  -3.232  1.00  0.00           H  
HETATM   33  H   UNL     1       1.571  -0.040  -2.291  1.00  0.00           H  
HETATM   34  H   UNL     1       3.029   2.373  -1.106  1.00  0.00           H  
HETATM   35  H   UNL     1       1.287   2.326  -1.494  1.00  0.00           H  
HETATM   36  H   UNL     1       0.646   0.877   1.817  1.00  0.00           H  
HETATM   37  H   UNL     1       1.196   4.228  -0.339  1.00  0.00           H  
HETATM   38  H   UNL     1       0.195   4.723   1.048  1.00  0.00           H  
HETATM   39  H   UNL     1       1.750   3.901   1.321  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.695   3.464   0.099  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.252   0.415   0.525  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.674   2.154  -0.242  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.152  -1.505   1.325  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.384  -2.066  -0.348  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.954  -1.093   0.074  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.622   0.822  -0.705  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.481  -2.241  -0.481  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    7    1    3    3                                       
CONECT    3    2    2    4   27                                       
CONECT    4    5    5    3   28                                       
CONECT    5    6    4    4   29                                       
CONECT    6   11    7    7    5                                       
CONECT    7    8    6    6    2                                       
CONECT    8    9    7   30   31                                       
CONECT    9   10    8   32   33                                       
CONECT   10    9   11   34   35                                       
CONECT   11   10   12   12    6                                       
CONECT   12   13   11   11   36                                       
CONECT   13   14   15   15   12                                       
CONECT   14   13   37   38   39                                       
CONECT   15   13   13   16   40                                       
CONECT   16   15   17   17   41                                       
CONECT   17   16   16   18   42                                       
CONECT   18   17   20   20   19                                       
CONECT   19   18   43   44   45                                       
CONECT   20   18   18   21   46                                       
CONECT   21   20   22   22   23                                       
CONECT   22   21   21                                                 
CONECT   23   21   47                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
