COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.890   2.944  -1.218  1.00  0.00           C  
HETATM    2  O   UNL     1      -5.944   2.146  -0.674  1.00  0.00           O  
HETATM    3  C   UNL     1      -5.368   1.015  -0.185  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.000   0.837  -0.283  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.155   0.038   0.419  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.500   0.212   0.514  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.570  -1.119   0.913  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.206  -1.300   0.818  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.412  -0.323   0.219  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.946  -0.517   0.116  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.436  -1.771  -0.192  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.083   0.563   0.335  1.00  0.00           C  
HETATM   13  C   UNL     1       0.267   0.399   0.243  1.00  0.00           C  
HETATM   14  C   UNL     1       0.799  -0.855  -0.071  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.060  -1.948  -0.294  1.00  0.00           C  
HETATM   16  N   UNL     1       0.735  -3.030  -0.578  1.00  0.00           N  
HETATM   17  N   UNL     1       2.078  -2.640  -0.539  1.00  0.00           N  
HETATM   18  C   UNL     1       2.165  -1.363  -0.244  1.00  0.00           C  
HETATM   19  C   UNL     1       3.410  -0.581  -0.109  1.00  0.00           C  
HETATM   20  N   UNL     1       4.675  -1.080  -0.274  1.00  0.00           N  
HETATM   21  C   UNL     1       5.556  -0.036  -0.065  1.00  0.00           C  
HETATM   22  C   UNL     1       6.939   0.076  -0.093  1.00  0.00           C  
HETATM   23  C   UNL     1       7.535   1.292   0.167  1.00  0.00           C  
HETATM   24  C   UNL     1       6.761   2.407   0.457  1.00  0.00           C  
HETATM   25  C   UNL     1       5.389   2.316   0.490  1.00  0.00           C  
HETATM   26  C   UNL     1       4.767   1.091   0.228  1.00  0.00           C  
HETATM   27  N   UNL     1       3.471   0.696   0.181  1.00  0.00           N  
HETATM   28  H   UNL     1      -5.306   3.866  -1.623  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.173   3.183  -0.432  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.389   2.391  -2.012  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.387   1.596  -0.748  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.665   0.656   1.357  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.184  -1.877   1.376  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.752  -2.200   1.207  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.104  -2.602  -0.360  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.490   1.533   0.579  1.00  0.00           H  
HETATM   37  H   UNL     1       0.926   1.238   0.414  1.00  0.00           H  
HETATM   38  H   UNL     1       0.416  -3.924  -0.775  1.00  0.00           H  
HETATM   39  H   UNL     1       4.909  -1.995  -0.497  1.00  0.00           H  
HETATM   40  H   UNL     1       7.547  -0.788  -0.317  1.00  0.00           H  
HETATM   41  H   UNL     1       8.611   1.377   0.146  1.00  0.00           H  
HETATM   42  H   UNL     1       7.241   3.353   0.659  1.00  0.00           H  
HETATM   43  H   UNL     1       4.793   3.188   0.717  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    4    5                                       
CONECT    4    3    3    9   31                                       
CONECT    5    3    6    7    7                                       
CONECT    6    5   32                                                 
CONECT    7    5    5    8   33                                       
CONECT    8    7    9    9   34                                       
CONECT    9    4    8    8   10                                       
CONECT   10    9   11   11   12                                       
CONECT   11   10   10   15   35                                       
CONECT   12   10   13   13   36                                       
CONECT   13   12   12   14   37                                       
CONECT   14   13   15   15   18                                       
CONECT   15   11   14   14   16                                       
CONECT   16   15   17   38                                            
CONECT   17   16   18   18                                            
CONECT   18   14   17   17   19                                       
CONECT   19   18   20   27   27                                       
CONECT   20   19   21   39                                            
CONECT   21   20   22   22   26                                       
CONECT   22   21   21   23   40                                       
CONECT   23   22   24   24   41                                       
CONECT   24   23   23   25   42                                       
CONECT   25   24   26   26   43                                       
CONECT   26   21   25   25   27                                       
CONECT   27   19   19   26                                            
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   16                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
