COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -1.267  -0.650   3.921  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.047  -0.245   3.535  1.00  0.00           C  
HETATM    3  OXT UNL     1       0.887  -0.336   4.294  1.00  0.00           O  
HETATM    4  CA  UNL     1       0.155   0.322   2.154  1.00  0.00           C  
HETATM    5  N   UNL     1       1.252   1.299   2.183  1.00  0.00           N  
HETATM    6  C   UNL     1       0.503  -0.807   1.183  1.00  0.00           C  
HETATM    7  C   UNL     1       0.706  -0.239  -0.197  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.409  -0.120  -1.146  1.00  0.00           C  
HETATM    9  C   UNL     1       1.908   0.171  -0.608  1.00  0.00           C  
HETATM   10  C   UNL     1       2.004   0.882  -1.924  1.00  0.00           C  
HETATM   11  C   UNL     1       2.021  -0.025  -3.160  1.00  0.00           C  
HETATM   12  C   UNL     1       0.946  -1.109  -3.009  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.305  -0.508  -2.441  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.481  -0.246  -3.007  1.00  0.00           O  
HETATM   15  N   UNL     1      -2.277   0.243  -2.230  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.768   0.391  -1.028  1.00  0.00           C  
HETATM   17  O   UNL     1      -2.373   0.900   0.073  1.00  0.00           O  
HETATM   18  H   UNL     1      -1.397  -1.015   4.807  1.00  0.00           H  
HETATM   19  HA  UNL     1      -0.760   0.814   1.825  1.00  0.00           H  
HETATM   20  H1  UNL     1       2.074   0.802   2.491  1.00  0.00           H  
HETATM   21  H2  UNL     1       1.421   1.574   1.227  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.310  -1.531   1.162  1.00  0.00           H  
HETATM   23  H   UNL     1       1.419  -1.299   1.512  1.00  0.00           H  
HETATM   24  H   UNL     1       2.789  -0.003  -0.008  1.00  0.00           H  
HETATM   25  H   UNL     1       2.915   1.480  -1.926  1.00  0.00           H  
HETATM   26  H   UNL     1       1.155   1.561  -2.010  1.00  0.00           H  
HETATM   27  H   UNL     1       3.000  -0.495  -3.253  1.00  0.00           H  
HETATM   28  H   UNL     1       1.816   0.568  -4.051  1.00  0.00           H  
HETATM   29  H   UNL     1       1.309  -1.889  -2.340  1.00  0.00           H  
HETATM   30  H   UNL     1       0.729  -1.543  -3.986  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.794   0.159   0.529  1.00  0.00           H  
CONECT    1    2   18                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5    6   19                                       
CONECT    5    4   20   21                                            
CONECT    6    4    7   22   23                                       
CONECT    7    6    8    9    9                                       
CONECT    8    7   13   13   16                                       
CONECT    9    7    7   10   24                                       
CONECT   10    9   11   25   26                                       
CONECT   11   10   12   27   28                                       
CONECT   12   11   13   29   30                                       
CONECT   13    8    8   12   14                                       
CONECT   14   13   15                                                 
CONECT   15   14   16   16                                            
CONECT   16    8   15   15   17                                       
CONECT   17   16   31                                                 
CONECT   18    1                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31   17                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
