COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.940  -0.665   1.006  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.291   0.709  -0.766  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.552   0.489  -0.227  1.00  0.00           C  
HETATM    4  O   UNL     1      -0.416   1.190  -1.459  1.00  0.00           O  
HETATM    5  N   UNL     1      -2.582   1.017  -1.000  1.00  0.00           N  
HETATM    6  O   UNL     1      -4.716   0.767  -0.438  1.00  0.00           O  
HETATM    7  N   UNL     1      -3.231  -0.357   0.773  1.00  0.00           N  
HETATM    8  O   UNL     1      -1.651  -1.428   1.907  1.00  0.00           O  
HETATM    9  N   UNL     1      -0.970  -0.132   0.237  1.00  0.00           N  
HETATM   10  C1* UNL     1       0.433  -0.467   0.491  1.00  0.00           C  
HETATM   11  O4* UNL     1       1.216   0.735   0.651  1.00  0.00           O  
HETATM   12  C4* UNL     1       2.581   0.337   0.398  1.00  0.00           C  
HETATM   13  C5* UNL     1       3.432   1.555   0.032  1.00  0.00           C  
HETATM   14  O5* UNL     1       3.536   2.421   1.163  1.00  0.00           O  
HETATM   15  C3* UNL     1       2.493  -0.636  -0.798  1.00  0.00           C  
HETATM   16  O3* UNL     1       3.434  -1.701  -0.647  1.00  0.00           O  
HETATM   17  C2* UNL     1       1.047  -1.178  -0.735  1.00  0.00           C  
HETATM   18  O2* UNL     1       1.051  -2.594  -0.544  1.00  0.00           O  
HETATM   19  H   UNL     1      -2.813   1.622  -1.722  1.00  0.00           H  
HETATM   20  H   UNL     1      -3.930  -0.744   1.323  1.00  0.00           H  
HETATM   21  H1* UNL     1       0.518  -1.096   1.378  1.00  0.00           H  
HETATM   22  H4* UNL     1       2.997  -0.167   1.270  1.00  0.00           H  
HETATM   23 H5*1 UNL     1       4.427   1.226  -0.267  1.00  0.00           H  
HETATM   24 H5*2 UNL     1       2.963   2.091  -0.794  1.00  0.00           H  
HETATM   25  H5* UNL     1       4.063   3.216   1.003  1.00  0.00           H  
HETATM   26  H3* UNL     1       2.664  -0.107  -1.735  1.00  0.00           H  
HETATM   27  H3* UNL     1       4.356  -1.411  -0.619  1.00  0.00           H  
HETATM   28  H2* UNL     1       0.501  -0.916  -1.641  1.00  0.00           H  
HETATM   29  H2* UNL     1       1.426  -3.090  -1.284  1.00  0.00           H  
CONECT    1    7    8    8    9                                       
CONECT    2    4    4    5    9                                       
CONECT    3    5    6    6    7                                       
CONECT    4    2    2                                                 
CONECT    5    2    3   19                                            
CONECT    6    3    3                                                 
CONECT    7    1    3   20                                            
CONECT    8    1    1                                                 
CONECT    9    1    2   10                                            
CONECT   10    9   11   17   21                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   15   22                                       
CONECT   13   12   14   23   24                                       
CONECT   14   13   25                                                 
CONECT   15   12   16   17   26                                       
CONECT   16   15   27                                                 
CONECT   17   10   15   18   28                                       
CONECT   18   17   29                                                 
CONECT   19    5                                                      
CONECT   20    7                                                      
CONECT   21   10                                                      
CONECT   22   12                                                      
CONECT   23   13                                                      
CONECT   24   13                                                      
CONECT   25   14                                                      
CONECT   26   15                                                      
CONECT   27   16                                                      
CONECT   28   17                                                      
CONECT   29   18                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
