COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.311   3.146  -0.205  1.00  0.00           N  
HETATM    2  N   UNL     1       0.804  -0.098   0.357  1.00  0.00           N  
HETATM    3  C   UNL     1       2.981   0.761  -0.361  1.00  0.00           C  
HETATM    4  C   UNL     1       3.407  -0.512  -0.678  1.00  0.00           C  
HETATM    5  C   UNL     1       1.234  -1.375   0.054  1.00  0.00           C  
HETATM    6  C   UNL     1       2.519  -1.597  -0.484  1.00  0.00           C  
HETATM    7  C   UNL     1       2.929  -2.904  -0.800  1.00  0.00           C  
HETATM    8  C   UNL     1       0.810  -3.742  -0.053  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.485   0.100   0.862  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.979   0.270   2.737  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.825   0.525   0.501  1.00  0.00           C  
HETATM   12  C   UNL     1       3.836   1.946  -0.547  1.00  0.00           C  
HETATM   13  C   UNL     1       2.066   3.244   0.282  1.00  0.00           C  
HETATM   14  N   UNL     1       1.253   2.208   0.464  1.00  0.00           N  
HETATM   15  C   UNL     1       1.630   0.971   0.169  1.00  0.00           C  
HETATM   16  C   UNL     1       0.380  -2.455   0.252  1.00  0.00           C  
HETATM   17  C   UNL     1       2.079  -3.950  -0.614  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.069  -4.854   0.152  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.767  -5.736   0.315  1.00  0.00           N  
HETATM   20  O   UNL     1       1.653   4.353   0.575  1.00  0.00           O  
HETATM   21  O   UNL     1       4.965   1.850  -0.989  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.706   0.075   2.234  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.038   0.491   1.880  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.543   0.328  -0.007  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.960   0.761  -0.419  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.253   0.967  -0.068  1.00  0.00           N  
HETATM   27  N   UNL     1      -3.903   0.818  -1.733  1.00  0.00           N  
HETATM   28  N   UNL     1      -5.068   1.038  -2.225  1.00  0.00           N  
HETATM   29  N   UNL     1      -5.941   1.141  -1.282  1.00  0.00           N  
HETATM   30  H   UNL     1       3.847   3.948  -0.310  1.00  0.00           H  
HETATM   31  H   UNL     1       4.400  -0.678  -1.069  1.00  0.00           H  
HETATM   32  H   UNL     1       3.920  -3.078  -1.192  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.146   0.244   3.803  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.614  -2.294   0.643  1.00  0.00           H  
HETATM   35  H   UNL     1       2.399  -4.952  -0.859  1.00  0.00           H  
HETATM   36  H   UNL     1       0.119  -0.099   2.909  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.031   0.638   2.277  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.372   0.353  -1.073  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.624   0.989   0.827  1.00  0.00           H  
CONECT    1   12   13   30                                            
CONECT    2   15    5    9                                            
CONECT    3   12    4    4   15                                       
CONECT    4    3    3    6   31                                       
CONECT    5    6    2   16   16                                       
CONECT    6    4    7    7    5                                       
CONECT    7    6    6   17   32                                       
CONECT    8   17   17   16   18                                       
CONECT    9    2   22   22   24                                       
CONECT   10   22   23   23   33                                       
CONECT   11   24   24   23   25                                       
CONECT   12   21   21    1    3                                       
CONECT   13    1   20   20   14                                       
CONECT   14   13   15   15                                            
CONECT   15    3   14   14    2                                       
CONECT   16    5    5    8   34                                       
CONECT   17    7    8    8   35                                       
CONECT   18    8   19   19   19                                       
CONECT   19   18   18   18                                            
CONECT   20   13   13                                                 
CONECT   21   12   12                                                 
CONECT   22    9    9   10   36                                       
CONECT   23   10   10   11   37                                       
CONECT   24    9   11   11   38                                       
CONECT   25   11   27   27   26                                       
CONECT   26   25   29   39                                            
CONECT   27   25   25   28                                            
CONECT   28   27   29   29                                            
CONECT   29   26   28   28                                            
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    7                                                      
CONECT   33   10                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   22                                                      
CONECT   37   23                                                      
CONECT   38   24                                                      
CONECT   39   26                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
