COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.056  -4.170   0.102  1.00  0.00           O  
HETATM    2  C   UNL     1       2.752  -3.174   0.137  1.00  0.00           C  
HETATM    3  C   UNL     1       4.249  -3.304   0.252  1.00  0.00           C  
HETATM    4  C   UNL     1       2.163  -1.904   0.064  1.00  0.00           C  
HETATM    5  N   UNL     1       0.804  -1.646  -0.050  1.00  0.00           N  
HETATM    6  C   UNL     1       0.625  -0.290  -0.092  1.00  0.00           C  
HETATM    7  C   UNL     1       1.893   0.324  -0.003  1.00  0.00           C  
HETATM    8  C   UNL     1       2.164   1.778  -0.010  1.00  0.00           C  
HETATM    9  N   UNL     1       1.155   2.636  -0.108  1.00  0.00           N  
HETATM   10  C   UNL     1       1.356   3.939  -0.117  1.00  0.00           C  
HETATM   11  C   UNL     1       2.631   4.462  -0.026  1.00  0.00           C  
HETATM   12  C   UNL     1       3.716   3.600   0.077  1.00  0.00           C  
HETATM   13  C   UNL     1       3.479   2.238   0.091  1.00  0.00           C  
HETATM   14  C   UNL     1       2.840  -0.690   0.098  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.267  -2.487  -0.118  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.523  -2.006  -0.229  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.746  -0.616  -0.275  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.662   0.243  -0.206  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.035  -0.114  -0.388  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.295   1.332  -0.307  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.416   1.565   0.713  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.533   0.737   0.382  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.260  -0.665   0.440  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.182  -1.012  -0.599  1.00  0.00           C  
HETATM   25  H   UNL     1       4.687  -3.354  -0.744  1.00  0.00           H  
HETATM   26  H   UNL     1       4.649  -2.440   0.783  1.00  0.00           H  
HETATM   27  H   UNL     1       4.493  -4.213   0.803  1.00  0.00           H  
HETATM   28  H   UNL     1       0.511   4.607  -0.197  1.00  0.00           H  
HETATM   29  H   UNL     1       2.784   5.531  -0.035  1.00  0.00           H  
HETATM   30  H   UNL     1       4.722   3.986   0.154  1.00  0.00           H  
HETATM   31  H   UNL     1       4.299   1.540   0.170  1.00  0.00           H  
HETATM   32  H   UNL     1       3.909  -0.558   0.183  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.108  -3.555  -0.084  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.358  -2.688  -0.282  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.809   1.313  -0.239  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.392   1.850   0.016  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.603   1.705  -1.283  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.058   1.312   1.711  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.718   2.612   0.688  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.905  -0.926   1.437  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.170  -1.223   0.219  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.578  -0.871  -1.605  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.866  -2.047  -0.471  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    4    1    1                                       
CONECT    3    2   25   26   27                                       
CONECT    4   14   14    2    5                                       
CONECT    5    4    6   15                                            
CONECT    6    7    7    5   18                                       
CONECT    7    8   14    6    6                                       
CONECT    8   13    7    9    9                                       
CONECT    9    8    8   10                                            
CONECT   10   11   11    9   28                                       
CONECT   11   12   10   10   29                                       
CONECT   12   13   13   11   30                                       
CONECT   13   12   12    8   31                                       
CONECT   14    7    4    4   32                                       
CONECT   15    5   16   16   33                                       
CONECT   16   15   15   17   34                                       
CONECT   17   18   18   16   19                                       
CONECT   18    6   17   17   35                                       
CONECT   19   17   24   20                                            
CONECT   20   21   19   36   37                                       
CONECT   21   22   20   38   39                                       
CONECT   22   23   21                                                 
CONECT   23   22   24   40   41                                       
CONECT   24   23   19   42   43                                       
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
