COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.404   0.043  -0.089  1.00  0.00           C  
HETATM    2  O   UNL     1      -2.578  -0.225  -0.234  1.00  0.00           O  
HETATM    3  C   UNL     1      -0.485   0.074  -1.235  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.836   0.358   1.277  1.00  0.00           C  
HETATM    5  C   UNL     1       0.510  -0.367   1.394  1.00  0.00           C  
HETATM    6  C   UNL     1       1.483   0.200   0.366  1.00  0.00           C  
HETATM    7  C   UNL     1       0.906   0.140  -1.023  1.00  0.00           C  
HETATM    8  C   UNL     1       1.758   0.157  -2.082  1.00  0.00           C  
HETATM    9  C   UNL     1       1.267   0.118  -3.401  1.00  0.00           C  
HETATM   10  C   UNL     1       2.143   0.136  -4.497  1.00  0.00           C  
HETATM   11  C   UNL     1       1.647   0.103  -5.767  1.00  0.00           C  
HETATM   12  C   UNL     1       0.278   0.050  -6.002  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.234   0.017  -7.419  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.614   0.028  -4.952  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.950  -0.023  -5.191  1.00  0.00           O  
HETATM   16  C   UNL     1      -0.129   0.060  -3.630  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.007   0.036  -2.531  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.345  -0.023  -2.727  1.00  0.00           O  
HETATM   19  C   UNL     1       3.261   0.298   3.329  1.00  0.00           C  
HETATM   20  C   UNL     1       1.078  -0.167   2.801  1.00  0.00           C  
HETATM   21  O   UNL     1       2.387  -0.735   2.871  1.00  0.00           O  
HETATM   22  C   UNL     1       0.182  -0.843   3.806  1.00  0.00           C  
HETATM   23  O   UNL     1       0.378  -1.995   4.110  1.00  0.00           O  
HETATM   24  C   UNL     1      -0.958  -0.083   4.431  1.00  0.00           C  
HETATM   25  O   UNL     1      -2.017  -0.988   4.749  1.00  0.00           O  
HETATM   26  C   UNL     1      -0.473   0.604   5.709  1.00  0.00           C  
HETATM   27  O   UNL     1       0.584   1.509   5.390  1.00  0.00           O  
HETATM   28  C   UNL     1      -1.632   1.376   6.343  1.00  0.00           C  
HETATM   29  H   UNL     1      -1.516   0.004   2.052  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.687   1.433   1.378  1.00  0.00           H  
HETATM   31  H   UNL     1       0.366  -1.432   1.209  1.00  0.00           H  
HETATM   32  H   UNL     1       1.702   1.238   0.617  1.00  0.00           H  
HETATM   33  H   UNL     1       2.409  -0.374   0.394  1.00  0.00           H  
HETATM   34  H   UNL     1       2.824   0.201  -1.910  1.00  0.00           H  
HETATM   35  H   UNL     1       3.210   0.175  -4.335  1.00  0.00           H  
HETATM   36  H   UNL     1       2.330   0.119  -6.604  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.395   1.036  -7.771  1.00  0.00           H  
HETATM   38  H   UNL     1       0.497  -0.476  -8.059  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.175  -0.531  -7.452  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.259   0.891  -5.250  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.661   0.889  -2.779  1.00  0.00           H  
HETATM   42  H   UNL     1       4.260  -0.111   3.482  1.00  0.00           H  
HETATM   43  H   UNL     1       3.305   1.093   2.584  1.00  0.00           H  
HETATM   44  H   UNL     1       2.886   0.702   4.269  1.00  0.00           H  
HETATM   45  H   UNL     1       1.132   0.899   3.022  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.322   0.668   3.729  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.654  -1.635   5.370  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.110  -0.146   6.410  1.00  0.00           H  
HETATM   49  H   UNL     1       0.222   2.156   4.769  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.286   1.866   7.254  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.995   2.128   5.642  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.439   0.686   6.586  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1    7    7   17                                       
CONECT    4    1    5   29   30                                       
CONECT    5    4    6   20   31                                       
CONECT    6    5    7   32   33                                       
CONECT    7    3    3    6    8                                       
CONECT    8    7    9    9   34                                       
CONECT    9    8    8   10   16                                       
CONECT   10    9   11   11   35                                       
CONECT   11   10   10   12   36                                       
CONECT   12   11   13   14   14                                       
CONECT   13   12   37   38   39                                       
CONECT   14   12   12   15   16                                       
CONECT   15   14   40                                                 
CONECT   16    9   14   17   17                                       
CONECT   17    3   16   16   18                                       
CONECT   18   17   41                                                 
CONECT   19   21   42   43   44                                       
CONECT   20    5   21   22   45                                       
CONECT   21   19   20                                                 
CONECT   22   20   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   26   46                                       
CONECT   25   24   47                                                 
CONECT   26   24   27   28   48                                       
CONECT   27   26   49                                                 
CONECT   28   26   50   51   52                                       
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
