COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.895  -0.713   0.224  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.598   0.650   0.049  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.276   1.024  -0.516  1.00  0.00           C  
HETATM    4  C   UNL     1       3.703   1.424   1.635  1.00  0.00           C  
HETATM    5  C   UNL     1       4.532   0.238   1.213  1.00  0.00           C  
HETATM    6  O   UNL     1       5.423  -0.164   1.930  1.00  0.00           O  
HETATM    7  N   UNL     1       4.282  -0.375   0.039  1.00  0.00           N  
HETATM    8  C   UNL     1       5.005  -1.599  -0.316  1.00  0.00           C  
HETATM    9  C   UNL     1       3.287   0.182  -0.881  1.00  0.00           C  
HETATM   10  C   UNL     1       1.894  -0.313  -0.487  1.00  0.00           C  
HETATM   11  N   UNL     1       0.897   0.245  -1.410  1.00  0.00           N  
HETATM   12  C   UNL     1       1.007  -0.517  -2.661  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.166   1.816   0.246  1.00  0.00           N  
HETATM   14  O   UNL     1      -2.403   2.693  -0.107  1.00  0.00           O  
HETATM   15  N   UNL     1      -1.330   2.329  -0.546  1.00  0.00           N  
HETATM   16  N   UNL     1      -4.202  -1.119   0.789  1.00  0.00           N1+
HETATM   17  O   UNL     1      -4.460  -2.300   0.940  1.00  0.00           O1-
HETATM   18  O   UNL     1      -5.019  -0.272   1.103  1.00  0.00           O  
HETATM   19  C   UNL     1      -1.986  -1.657  -0.125  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.737  -1.340  -0.664  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.352  -0.046  -0.873  1.00  0.00           C  
HETATM   22  H   UNL     1       3.015   1.691   0.832  1.00  0.00           H  
HETATM   23  H   UNL     1       3.135   1.171   2.531  1.00  0.00           H  
HETATM   24  H   UNL     1       4.358   2.269   1.847  1.00  0.00           H  
HETATM   25  H   UNL     1       5.759  -1.809   0.443  1.00  0.00           H  
HETATM   26  H   UNL     1       4.304  -2.432  -0.372  1.00  0.00           H  
HETATM   27  H   UNL     1       5.489  -1.467  -1.283  1.00  0.00           H  
HETATM   28  H   UNL     1       3.314   1.270  -0.830  1.00  0.00           H  
HETATM   29  H   UNL     1       3.513  -0.140  -1.898  1.00  0.00           H  
HETATM   30  H   UNL     1       1.867  -1.402  -0.538  1.00  0.00           H  
HETATM   31  H   UNL     1       1.668   0.009   0.529  1.00  0.00           H  
HETATM   32  H   UNL     1       0.283  -0.138  -3.382  1.00  0.00           H  
HETATM   33  H   UNL     1       2.013  -0.409  -3.066  1.00  0.00           H  
HETATM   34  H   UNL     1       0.806  -1.570  -2.464  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.238  -2.697   0.019  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.057  -2.138  -0.922  1.00  0.00           H  
CONECT    1    2   16   19   19                                       
CONECT    2    1    3   13   13                                       
CONECT    3    2   15   15   21                                       
CONECT    4    5   22   23   24                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    8    9                                            
CONECT    8    7   25   26   27                                       
CONECT    9    7   10   28   29                                       
CONECT   10    9   11   30   31                                       
CONECT   11   10   12   21                                            
CONECT   12   11   32   33   34                                       
CONECT   13    2    2   14                                            
CONECT   14   13   15                                                 
CONECT   15    3    3   14                                            
CONECT   16    1   17   18   18                                       
CONECT   17   16                                                      
CONECT   18   16   16                                                 
CONECT   19    1    1   20   35                                       
CONECT   20   19   21   21   36                                       
CONECT   21    3   11   20   20                                       
CONECT   22    4                                                      
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
