COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.939   2.724   0.363  1.00  0.00           C  
HETATM    2  C   UNL     1       0.664   1.831  -0.230  1.00  0.00           C  
HETATM    3  C   UNL     1       0.081   0.646  -0.467  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.364   0.413  -0.826  1.00  0.00           C  
HETATM    5  CA  UNL     1      -2.159   0.092   0.442  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.622  -0.019   0.102  1.00  0.00           C  
HETATM    7  C   UNL     1       1.116  -0.379  -0.311  1.00  0.00           C  
HETATM    8  C   UNL     1       1.129  -1.771  -0.426  1.00  0.00           C  
HETATM    9  C   UNL     1       2.291  -2.458  -0.212  1.00  0.00           C  
HETATM   10  C   UNL     1       3.458  -1.784   0.119  1.00  0.00           C  
HETATM   11  C   UNL     1       3.468  -0.412   0.238  1.00  0.00           C  
HETATM   12  C   UNL     1       2.297   0.308   0.024  1.00  0.00           C  
HETATM   13  N   UNL     1       1.990   1.650   0.059  1.00  0.00           N  
HETATM   14  N   UNL     1      -1.689  -1.180   1.006  1.00  0.00           N  
HETATM   15  O   UNL     1      -4.128  -1.107  -0.041  1.00  0.00           O  
HETATM   16  OXT UNL     1      -4.364   1.090  -0.043  1.00  0.00           O  
HETATM   17  H   UNL     1       3.405   3.069  -0.560  1.00  0.00           H  
HETATM   18  H   UNL     1       2.412   3.552   0.836  1.00  0.00           H  
HETATM   19  H   UNL     1       3.707   2.348   1.040  1.00  0.00           H  
HETATM   20  H   UNL     1       0.163   2.787  -0.266  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.771   1.310  -1.293  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.435  -0.423  -1.521  1.00  0.00           H  
HETATM   23  HA  UNL     1      -2.015   0.889   1.172  1.00  0.00           H  
HETATM   24  H   UNL     1       0.225  -2.302  -0.682  1.00  0.00           H  
HETATM   25  H   UNL     1       2.300  -3.534  -0.301  1.00  0.00           H  
HETATM   26  H   UNL     1       4.368  -2.341   0.286  1.00  0.00           H  
HETATM   27  H   UNL     1       4.381   0.103   0.497  1.00  0.00           H  
HETATM   28  H1  UNL     1      -1.811  -1.935   0.347  1.00  0.00           H  
HETATM   29  H2  UNL     1      -0.726  -1.111   1.302  1.00  0.00           H  
HETATM   30  HXT UNL     1      -5.299   0.968  -0.261  1.00  0.00           H  
CONECT    1   13   17   18   19                                       
CONECT    2   13    3    3   20                                       
CONECT    3    2    2    7    4                                       
CONECT    4    3    5   21   22                                       
CONECT    5    4    6   14   23                                       
CONECT    6   15   15    5   16                                       
CONECT    7   12   12    8    3                                       
CONECT    8    9    9    7   24                                       
CONECT    9   10    8    8   25                                       
CONECT   10   11   11    9   26                                       
CONECT   11   10   10   12   27                                       
CONECT   12   11   13    7    7                                       
CONECT   13    1   12    2                                            
CONECT   14    5   28   29                                            
CONECT   15    6    6                                                 
CONECT   16    6   30                                                 
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    4                                                      
CONECT   22    4                                                      
CONECT   23    5                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   16                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
