COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.633   1.877  -0.792  1.00  0.00           N  
HETATM    2  C   UNL     1       2.550  -0.483  -0.354  1.00  0.00           C  
HETATM    3  C   UNL     1       3.918   0.045  -0.333  1.00  0.00           C  
HETATM    4  C   UNL     1       4.030   1.557  -0.461  1.00  0.00           C  
HETATM    5  C   UNL     1       2.947   2.196   0.414  1.00  0.00           C  
HETATM    6  C   UNL     1       1.551   1.843  -0.106  1.00  0.00           C  
HETATM    7  C   UNL     1       3.096   1.683   1.848  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.844   1.308  -0.909  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.188  -0.518   0.643  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.979  -3.056   0.832  1.00  0.00           C  
HETATM   11  O   UNL     1      -5.884   0.189   0.630  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.140   0.855  -0.064  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.698   0.543  -0.111  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.498   1.007  -0.966  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.840  -0.806   0.596  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.297  -1.774   1.381  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.285  -2.878  -0.524  1.00  0.00           C  
HETATM   18  C   UNL     1       0.713  -1.752  -0.435  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.998  -0.053  -0.231  1.00  0.00           C  
HETATM   20  N   UNL     1       0.353  -0.427  -0.304  1.00  0.00           N  
HETATM   21  C   UNL     1       1.438   0.347  -0.254  1.00  0.00           C  
HETATM   22  C   UNL     1       3.119   3.717   0.404  1.00  0.00           C  
HETATM   23  O   UNL     1       4.891  -0.673  -0.223  1.00  0.00           O  
HETATM   24  C   UNL     1       2.052  -1.844  -0.474  1.00  0.00           C  
HETATM   25  C   UNL     1       2.872  -3.101  -0.615  1.00  0.00           C  
HETATM   26  H   UNL     1      -6.580   2.082  -0.761  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.038   2.411  -1.343  1.00  0.00           H  
HETATM   28  H   UNL     1       5.014   1.882  -0.124  1.00  0.00           H  
HETATM   29  H   UNL     1       3.883   1.849  -1.501  1.00  0.00           H  
HETATM   30  H   UNL     1       0.799   2.199   0.599  1.00  0.00           H  
HETATM   31  H   UNL     1       1.394   2.315  -1.076  1.00  0.00           H  
HETATM   32  H   UNL     1       2.964   0.601   1.862  1.00  0.00           H  
HETATM   33  H   UNL     1       4.089   1.933   2.222  1.00  0.00           H  
HETATM   34  H   UNL     1       2.341   2.150   2.481  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.237   2.135  -1.482  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.848  -1.110   1.261  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.314  -3.587   1.513  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.895  -3.630   0.698  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.837   1.598  -1.582  1.00  0.00           H  
HETATM   40  H   UNL     1       0.231  -3.800  -0.791  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.029  -2.644  -1.285  1.00  0.00           H  
HETATM   42  H   UNL     1       2.364   4.172   1.045  1.00  0.00           H  
HETATM   43  H   UNL     1       4.112   3.973   0.773  1.00  0.00           H  
HETATM   44  H   UNL     1       3.003   4.089  -0.614  1.00  0.00           H  
HETATM   45  H   UNL     1       3.092  -3.503   0.373  1.00  0.00           H  
HETATM   46  H   UNL     1       2.311  -3.837  -1.191  1.00  0.00           H  
HETATM   47  H   UNL     1       3.804  -2.871  -1.131  1.00  0.00           H  
CONECT    1   12   26   27                                            
CONECT    2   21   21    3   24                                       
CONECT    3    4   23   23    2                                       
CONECT    4    5    3   28   29                                       
CONECT    5    7   22    6    4                                       
CONECT    6    5   21   30   31                                       
CONECT    7    5   32   33   34                                       
CONECT    8   13   13   14   35                                       
CONECT    9   15   15   13   36                                       
CONECT   10   16   17   37   38                                       
CONECT   11   12   12                                                 
CONECT   12   11   11   13    1                                       
CONECT   13    9   12    8    8                                       
CONECT   14   19   19    8   39                                       
CONECT   15   16    9    9   19                                       
CONECT   16   15   10                                                 
CONECT   17   10   18   40   41                                       
CONECT   18   20   24   24   17                                       
CONECT   19   15   20   14   14                                       
CONECT   20   21   19   18                                            
CONECT   21    6   20    2    2                                       
CONECT   22    5   42   43   44                                       
CONECT   23    3    3                                                 
CONECT   24    2   18   18   25                                       
CONECT   25   24   45   46   47                                       
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   14                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
