COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.114   1.022   0.279  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.565   1.240   0.101  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.855   0.275  -0.073  1.00  0.00           C  
HETATM    4  C   UNL     1       1.155   1.726  -0.075  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.197   1.936  -0.245  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.800  -2.275  -0.370  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.170  -2.080  -0.374  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.012   2.370   0.088  1.00  0.00           O  
HETATM    9  O   UNL     1       5.937  -0.122  -0.679  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.948  -1.202  -0.206  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.471   0.085  -0.062  1.00  0.00           C  
HETATM   12  N   UNL     1       3.494   0.331  -1.620  1.00  0.00           N  
HETATM   13  C   UNL     1      -5.695  -0.808  -0.227  1.00  0.00           C  
HETATM   14  C   UNL     1       1.604   0.612   0.613  1.00  0.00           C  
HETATM   15  C   UNL     1       0.702  -0.294   1.140  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.654  -0.097   0.977  1.00  0.00           C  
HETATM   17  C   UNL     1       3.084   0.389   0.794  1.00  0.00           C  
HETATM   18  CA  UNL     1       3.622  -0.439  -0.375  1.00  0.00           C  
HETATM   19  C   UNL     1       5.073  -0.766  -0.133  1.00  0.00           C  
HETATM   20  H   UNL     1      -5.266   1.267   0.042  1.00  0.00           H  
HETATM   21  H   UNL     1       1.865   2.432  -0.479  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.547   2.805  -0.782  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.397  -3.270  -0.486  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.832  -2.923  -0.503  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.879  -1.356  -0.198  1.00  0.00           H  
HETATM   26  H1  UNL     1       2.525   0.507  -1.838  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.765  -0.663  -0.231  1.00  0.00           H  
HETATM   28  H   UNL     1       1.059  -1.162   1.675  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.357  -0.805   1.389  1.00  0.00           H  
HETATM   30  H   UNL     1       3.595   1.351   0.823  1.00  0.00           H  
HETATM   31  H   UNL     1       3.259  -0.145   1.728  1.00  0.00           H  
HETATM   32  HA  UNL     1       3.050  -1.363  -0.459  1.00  0.00           H  
HETATM   33  OXT UNL     1       5.405  -1.773   0.690  1.00  0.00           O  
HETATM   34  HXT UNL     1       6.349  -1.946   0.814  1.00  0.00           H  
HETATM   35  H2  UNL     1       4.016   1.193  -1.567  1.00  0.00           H  
CONECT    1   16   16    5    2                                       
CONECT    2    1    8    8   11                                       
CONECT    3   11   13   13   20                                       
CONECT    4   14    5    5   21                                       
CONECT    5    4    4    1   22                                       
CONECT    6   10    7    7   23                                       
CONECT    7    6    6   13   24                                       
CONECT    8    2    2                                                 
CONECT    9   19   19                                                 
CONECT   10   11   11    6   25                                       
CONECT   11    2   10   10    3                                       
CONECT   12   18   26   35                                            
CONECT   13    3    3    7   27                                       
CONECT   14   17   15   15    4                                       
CONECT   15   14   14   16   28                                       
CONECT   16   15    1    1   29                                       
CONECT   17   18   14   30   31                                       
CONECT   18   19   12   17   32                                       
CONECT   19    9    9   18   33                                       
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25   10                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   15                                                      
CONECT   29   16                                                      
CONECT   30   17                                                      
CONECT   31   17                                                      
CONECT   32   18                                                      
CONECT   33   19   34                                                 
CONECT   34   33                                                      
CONECT   35   12                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
