COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.250  -0.654  -0.932  1.00  0.00           C  
HETATM    2  CA  UNL     1      -3.751   0.087  -0.196  1.00  0.00           C  
HETATM    3  C   UNL     1       0.758  -0.118   0.087  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.647  -0.484  -0.393  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.117   0.662  -0.467  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.373  -0.602   0.897  1.00  0.00           C  
HETATM    7  C   UNL     1       4.584  -0.037   0.076  1.00  0.00           C  
HETATM    8  O   UNL     1       5.226   0.837  -0.458  1.00  0.00           O  
HETATM    9  CA  UNL     1       3.184   0.245   0.559  1.00  0.00           C  
HETATM   10  C   UNL     1       2.176  -0.291  -0.460  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.658   0.159  -1.017  1.00  0.00           N  
HETATM   12  N   UNL     1      -2.082  -0.937   0.751  1.00  0.00           N  
HETATM   13  O   UNL     1      -5.983   0.373   0.633  1.00  0.00           O  
HETATM   14  N   UNL     1       3.001   1.694   0.713  1.00  0.00           N  
HETATM   15  H   UNL     1      -0.151  -0.102  -1.866  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.057  -1.712  -1.112  1.00  0.00           H  
HETATM   17  H   UNL     1       0.565   0.939   0.268  1.00  0.00           H  
HETATM   18  H   UNL     1       0.659  -0.670   1.021  1.00  0.00           H  
HETATM   19  H1  UNL     1      -5.038   1.742  -0.593  1.00  0.00           H  
HETATM   20  H2  UNL     1      -5.525   0.219  -1.375  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.999  -0.843   1.744  1.00  0.00           H  
HETATM   22  HA  UNL     1       3.026  -0.246   1.519  1.00  0.00           H  
HETATM   23  H   UNL     1       2.370  -1.349  -0.640  1.00  0.00           H  
HETATM   24  H   UNL     1       2.276   0.261  -1.394  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.617   0.591  -1.884  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.881   0.715   0.527  1.00  0.00           H  
HETATM   27  H1  UNL     1       3.143   2.171  -0.165  1.00  0.00           H  
HETATM   28  OXT UNL     1       5.118  -1.257   0.240  1.00  0.00           O  
HETATM   29  HXT UNL     1       6.019  -1.390  -0.086  1.00  0.00           H  
HETATM   30  H2  UNL     1       2.092   1.905   1.097  1.00  0.00           H  
CONECT    1    4    3   15   16                                       
CONECT    2    5   11    6    6                                       
CONECT    3    1   10   17   18                                       
CONECT    4    1   11   12   12                                       
CONECT    5    2   13   19   20                                       
CONECT    6    2    2   12   21                                       
CONECT    7    8    8    9   28                                       
CONECT    8    7    7                                                 
CONECT    9    7   14   10   22                                       
CONECT   10    3    9   23   24                                       
CONECT   11    2    4   25                                            
CONECT   12    4    4    6                                            
CONECT   13    5   26                                                 
CONECT   14    9   27   30                                            
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    3                                                      
CONECT   18    3                                                      
CONECT   19    5                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    9                                                      
CONECT   23   10                                                      
CONECT   24   10                                                      
CONECT   25   11                                                      
CONECT   26   13                                                      
CONECT   27   14                                                      
CONECT   28    7   29                                                 
CONECT   29   28                                                      
CONECT   30   14                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
