COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.430  -1.805  -0.564  1.00  0.00           C  
HETATM    2  C   UNL     1       4.485  -1.121   0.041  1.00  0.00           C  
HETATM    3  C   UNL     1       4.287   0.131   0.588  1.00  0.00           C  
HETATM    4  C   UNL     1       2.187  -1.248  -0.625  1.00  0.00           C  
HETATM    5  N   UNL     1       2.514   1.910   0.973  1.00  0.00           N  
HETATM    6  N   UNL     1       1.155   1.973   0.646  1.00  0.00           N  
HETATM    7  C   UNL     1       0.793   0.885   0.028  1.00  0.00           C  
HETATM    8  C   UNL     1       1.964   0.020  -0.077  1.00  0.00           C  
HETATM    9  C   UNL     1       3.024   0.715   0.535  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.590   0.574  -0.485  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.580   0.580   0.682  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.988   1.592  -1.471  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.295   2.377  -2.233  1.00  0.00           N  
HETATM   14  O   UNL     1       5.717  -1.692   0.092  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.959   0.143   0.183  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.894  -1.312  -0.285  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.273  -1.749  -0.784  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.289  -1.624   0.352  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.354  -0.169   0.821  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.976   0.268   1.319  1.00  0.00           C  
HETATM   21  H   UNL     1       3.601  -2.781  -0.992  1.00  0.00           H  
HETATM   22  H   UNL     1       5.108   0.655   1.055  1.00  0.00           H  
HETATM   23  H   UNL     1       1.376  -1.785  -1.096  1.00  0.00           H  
HETATM   24  H   UNL     1       3.014   2.600   1.435  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.590  -0.409  -0.956  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.237  -0.109   1.453  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.646   1.586   1.097  1.00  0.00           H  
HETATM   28  H   UNL     1       6.278  -1.487  -0.668  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.263   0.779  -0.648  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.169  -1.401  -1.095  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.590  -1.948   0.546  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.576  -1.113  -1.615  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.226  -2.786  -1.117  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.272  -1.936  -0.003  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.985  -2.260   1.184  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.658   0.467  -0.011  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.079  -0.079   1.630  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.671  -0.368   2.151  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.022   1.305   1.653  1.00  0.00           H  
CONECT    1    4    4    2   21                                       
CONECT    2    1   14    3    3                                       
CONECT    3    2    2    9   22                                       
CONECT    4    1    1    8   23                                       
CONECT    5    9    6   24                                            
CONECT    6    7    7    5                                            
CONECT    7    8   10    6    6                                       
CONECT    8    4    7    9    9                                       
CONECT    9    8    8    3    5                                       
CONECT   10   11   12    7   25                                       
CONECT   11   15   10   26   27                                       
CONECT   12   13   13   13   10                                       
CONECT   13   12   12   12                                            
CONECT   14    2   28                                                 
CONECT   15   16   11   20   29                                       
CONECT   16   17   15   30   31                                       
CONECT   17   16   18   32   33                                       
CONECT   18   17   19   34   35                                       
CONECT   19   18   20   36   37                                       
CONECT   20   15   19   38   39                                       
CONECT   21    1                                                      
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25   10                                                      
CONECT   26   11                                                      
CONECT   27   11                                                      
CONECT   28   14                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
