COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.804  -0.807   0.281  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.880  -2.319   0.001  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.550  -2.667  -0.705  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.615  -1.510  -0.271  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.516  -0.329  -0.266  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.961   0.752   0.560  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.771   1.387  -0.162  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.729   0.409  -0.368  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.122   2.474   0.723  1.00  0.00           C  
HETATM   10  O   UNL     1      -1.583   3.772   0.340  1.00  0.00           O  
HETATM   11  C   UNL     1       0.391   2.332   0.444  1.00  0.00           C  
HETATM   12  C   UNL     1       0.477   1.176  -0.577  1.00  0.00           C  
HETATM   13  N   UNL     1       1.659   0.351  -0.313  1.00  0.00           N  
HETATM   14  C   UNL     1       1.503  -0.962   0.042  1.00  0.00           C  
HETATM   15  C   UNL     1       2.592  -1.722   0.284  1.00  0.00           C  
HETATM   16  C   UNL     1       2.441  -3.169   0.676  1.00  0.00           C  
HETATM   17  C   UNL     1       3.878  -1.142   0.164  1.00  0.00           C  
HETATM   18  O   UNL     1       4.875  -1.808   0.377  1.00  0.00           O  
HETATM   19  N   UNL     1       3.989   0.155  -0.188  1.00  0.00           N  
HETATM   20  C   UNL     1       2.886   0.889  -0.429  1.00  0.00           C  
HETATM   21  O   UNL     1       3.002   2.056  -0.750  1.00  0.00           O  
HETATM   22  H   UNL     1      -5.630  -0.295  -0.213  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.841  -0.626   1.356  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.969  -2.873   0.936  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.724  -2.541  -0.652  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.166  -3.625  -0.354  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.678  -2.674  -1.787  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.214  -1.692   0.726  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.809  -1.376  -0.993  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.728   1.508   0.731  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.632   0.346   1.516  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.088   1.810  -1.115  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.338   2.289   1.775  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.207   4.493   0.863  1.00  0.00           H  
HETATM   35  H   UNL     1       0.788   3.252   0.014  1.00  0.00           H  
HETATM   36  H   UNL     1       0.925   2.075   1.358  1.00  0.00           H  
HETATM   37  H   UNL     1       0.506   1.568  -1.593  1.00  0.00           H  
HETATM   38  H   UNL     1       0.514  -1.387   0.128  1.00  0.00           H  
HETATM   39  H   UNL     1       2.435  -3.790  -0.221  1.00  0.00           H  
HETATM   40  H   UNL     1       3.274  -3.462   1.315  1.00  0.00           H  
HETATM   41  H   UNL     1       1.504  -3.303   1.216  1.00  0.00           H  
HETATM   42  H   UNL     1       4.866   0.559  -0.272  1.00  0.00           H  
CONECT    1    2    5   22   23                                       
CONECT    2    1    3   24   25                                       
CONECT    3    2    4   26   27                                       
CONECT    4    3    5   28   29                                       
CONECT    5    1    4    6                                            
CONECT    6    5    7   30   31                                       
CONECT    7    6    8    9   32                                       
CONECT    8    7   12                                                 
CONECT    9    7   10   11   33                                       
CONECT   10    9   34                                                 
CONECT   11    9   12   35   36                                       
CONECT   12    8   11   13   37                                       
CONECT   13   12   14   20                                            
CONECT   14   13   15   15   38                                       
CONECT   15   14   14   16   17                                       
CONECT   16   15   39   40   41                                       
CONECT   17   15   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   42                                            
CONECT   20   13   19   21   21                                       
CONECT   21   20   20                                                 
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   19                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
