COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.917  -0.885  -0.003  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.850  -0.006  -0.001  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.304   0.256   0.006  1.00  0.00           C  
HETATM    4  C   UNL     1       0.079  -1.090   0.003  1.00  0.00           C  
HETATM    5  C   UNL     1       1.403  -1.423   0.001  1.00  0.00           C  
HETATM    6  C   UNL     1       2.377  -0.418   0.002  1.00  0.00           C  
HETATM    7  C   UNL     1       3.803  -0.776   0.000  1.00  0.00           C  
HETATM    8  C   UNL     1       4.742   0.193   0.001  1.00  0.00           C  
HETATM    9  C   UNL     1       6.162  -0.163  -0.002  1.00  0.00           C  
HETATM   10  C   UNL     1       1.993   0.929   0.005  1.00  0.00           C  
HETATM   11  C   UNL     1       0.669   1.261   0.007  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.387   1.302  -0.003  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.834  -2.389  -0.001  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.595   2.584  -0.004  1.00  0.00           C  
HETATM   15  O   UNL     1       6.496  -1.334  -0.005  1.00  0.00           O  
HETATM   16  N   UNL     1       7.100   0.805  -0.001  1.00  0.00           N  
HETATM   17  O   UNL     1       8.473   0.460  -0.003  1.00  0.00           O  
HETATM   18  N   UNL     1      -1.629   0.588   0.003  1.00  0.00           N  
HETATM   19  N   UNL     1      -2.527  -0.338   0.002  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.688   1.205  -0.006  1.00  0.00           N  
HETATM   21  N   UNL     1      -6.043  -0.149   0.001  1.00  0.00           N  
HETATM   22  C   UNL     1      -7.410  -0.676   0.000  1.00  0.00           C  
HETATM   23  H   UNL     1      -0.673  -1.865   0.002  1.00  0.00           H  
HETATM   24  H   UNL     1       1.698  -2.462   0.000  1.00  0.00           H  
HETATM   25  H   UNL     1       4.099  -1.814  -0.003  1.00  0.00           H  
HETATM   26  H   UNL     1       4.446   1.232   0.003  1.00  0.00           H  
HETATM   27  H   UNL     1       2.744   1.705   0.006  1.00  0.00           H  
HETATM   28  H   UNL     1       0.373   2.299   0.009  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.816  -2.751   1.027  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.702  -2.802  -0.516  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.924  -2.704  -0.513  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.403   2.892  -1.031  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.163   3.361   0.509  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.648   2.426   0.512  1.00  0.00           H  
HETATM   35  H   UNL     1       6.834   1.738   0.001  1.00  0.00           H  
HETATM   36  H   UNL     1       9.070   1.221  -0.003  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.747  -0.812  -1.027  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.430  -1.635   0.519  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.070   0.026   0.509  1.00  0.00           H  
CONECT    1   21   13    2    2                                       
CONECT    2   12    1    1   19                                       
CONECT    3   18   11   11    4                                       
CONECT    4    3    5    5   23                                       
CONECT    5    4    4    6   24                                       
CONECT    6   10   10    5    7                                       
CONECT    7    6    8    8   25                                       
CONECT    8    7    7    9   26                                       
CONECT    9    8   15   15   16                                       
CONECT   10   11    6    6   27                                       
CONECT   11    3    3   10   28                                       
CONECT   12   20   20   14    2                                       
CONECT   13    1   29   30   31                                       
CONECT   14   12   32   33   34                                       
CONECT   15    9    9                                                 
CONECT   16    9   17   35                                            
CONECT   17   16   36                                                 
CONECT   18   19   19    3                                            
CONECT   19    2   18   18                                            
CONECT   20   21   12   12                                            
CONECT   21   22   20    1                                            
CONECT   22   21   37   38   39                                       
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    7                                                      
CONECT   26    8                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   13                                                      
CONECT   30   13                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   22                                                      
CONECT   38   22                                                      
CONECT   39   22                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
