COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.469   3.781   1.158  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.705   3.224   0.316  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.213   0.924  -0.502  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.942  -0.949  -1.606  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.349  -0.189  -0.507  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.696  -0.380   0.068  1.00  0.00           C  
HETATM    7  C   UNL     1       2.059  -1.525   0.329  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.071  -2.592   0.841  1.00  0.00           C  
HETATM    9  O   UNL     1       3.790  -3.213   0.392  1.00  0.00           O  
HETATM   10  C   UNL     1       3.524  -1.834   0.651  1.00  0.00           C  
HETATM   11  C   UNL     1       4.424  -0.964  -0.233  1.00  0.00           C  
HETATM   12  O   UNL     1       4.212  -1.298  -1.606  1.00  0.00           O  
HETATM   13  C   UNL     1       4.077   0.510  -0.006  1.00  0.00           C  
HETATM   14  C   UNL     1       4.930   1.383  -0.929  1.00  0.00           C  
HETATM   15  O   UNL     1       4.692   2.761  -0.636  1.00  0.00           O  
HETATM   16  O   UNL     1       2.694   0.723  -0.294  1.00  0.00           O  
HETATM   17  C   UNL     1       1.803  -0.029   0.534  1.00  0.00           C  
HETATM   18  O   UNL     1       0.453   0.276   0.181  1.00  0.00           O  
HETATM   19  C   UNL     1       0.030   1.548   0.405  1.00  0.00           C  
HETATM   20  C   UNL     1       0.899   2.486   0.937  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.829   4.148   0.851  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.280   1.918   0.084  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.819   0.159  -1.599  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.684  -0.771  -2.143  1.00  0.00           C  
HETATM   25  O   UNL     1      -6.048   0.282   1.024  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.535  -1.289  -0.467  1.00  0.00           O  
HETATM   27  C   UNL     1      -3.480   0.751   0.045  1.00  0.00           C  
HETATM   28  N   UNL     1       1.188  -2.296   1.219  1.00  0.00           N  
HETATM   29  C   UNL     1      -0.966  -3.386   1.757  1.00  0.00           C  
HETATM   30  O   UNL     1      -0.484  -2.219  -0.236  1.00  0.00           O  
HETATM   31  H   UNL     1       1.148   4.509   1.577  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.718   3.513   0.079  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.614  -1.678  -2.036  1.00  0.00           H  
HETATM   34  H   UNL     1       1.848  -1.791  -0.707  1.00  0.00           H  
HETATM   35  H   UNL     1       4.701  -3.479   0.575  1.00  0.00           H  
HETATM   36  H   UNL     1       3.720  -1.615   1.701  1.00  0.00           H  
HETATM   37  H   UNL     1       5.468  -1.137   0.029  1.00  0.00           H  
HETATM   38  H   UNL     1       4.747  -0.782  -2.223  1.00  0.00           H  
HETATM   39  H   UNL     1       4.277   0.775   1.032  1.00  0.00           H  
HETATM   40  H   UNL     1       5.985   1.155  -0.772  1.00  0.00           H  
HETATM   41  H   UNL     1       4.666   1.181  -1.967  1.00  0.00           H  
HETATM   42  H   UNL     1       5.201   3.373  -1.185  1.00  0.00           H  
HETATM   43  H   UNL     1       1.974   0.229   1.579  1.00  0.00           H  
HETATM   44  H   UNL     1       1.913   2.206   1.178  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.160   5.160   1.031  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.835   0.293  -2.024  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.373  -1.362  -2.993  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.405  -1.378  -0.056  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.789   1.342   0.895  1.00  0.00           H  
HETATM   50  H   UNL     1       1.519  -2.595   2.081  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.848  -4.449   1.549  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.694  -3.187   2.794  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.004  -3.096   1.592  1.00  0.00           H  
CONECT    1   20   21   21   31                                       
CONECT    2   22   22   21   32                                       
CONECT    3   22   23   23   27                                       
CONECT    4   24   24    5   33                                       
CONECT    5   27   27    4    6                                       
CONECT    6   25   25    5   26                                       
CONECT    7   10   17   28   34                                       
CONECT    8   28   30   30   29                                       
CONECT    9   10   35                                                 
CONECT   10   11    9    7   36                                       
CONECT   11   13   12   10   37                                       
CONECT   12   11   38                                                 
CONECT   13   14   11   16   39                                       
CONECT   14   13   15   40   41                                       
CONECT   15   14   42                                                 
CONECT   16   13   17                                                 
CONECT   17   16    7   18   43                                       
CONECT   18   17   19                                                 
CONECT   19   18   20   20   22                                       
CONECT   20   19   19    1   44                                       
CONECT   21    1    1    2   45                                       
CONECT   22   19    3    2    2                                       
CONECT   23    3    3   24   46                                       
CONECT   24   23    4    4   47                                       
CONECT   25    6    6                                                 
CONECT   26    6   48                                                 
CONECT   27    3    5    5   49                                       
CONECT   28    7    8   50                                            
CONECT   29    8   51   52   53                                       
CONECT   30    8    8                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    4                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
