COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.140   0.863  -0.016  1.00  0.00           C  
HETATM    2  O   UNL     1       5.025   1.895  -0.016  1.00  0.00           O  
HETATM    3  C   UNL     1       4.602  -0.448  -0.013  1.00  0.00           C  
HETATM    4  C   UNL     1       3.715  -1.503  -0.007  1.00  0.00           C  
HETATM    5  C   UNL     1       2.345  -1.263  -0.004  1.00  0.00           C  
HETATM    6  C   UNL     1       1.878   0.059  -0.007  1.00  0.00           C  
HETATM    7  C   UNL     1       2.780   1.119  -0.013  1.00  0.00           C  
HETATM    8  N   UNL     1       1.250  -2.113   0.001  1.00  0.00           N  
HETATM    9  C   UNL     1       0.078  -1.386   0.001  1.00  0.00           C  
HETATM   10  C   UNL     1       0.405  -0.019  -0.003  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.264  -1.774   0.004  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.625  -3.237   0.010  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.242  -0.833   0.004  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.930   0.537  -0.001  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.599   0.942  -0.003  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.249   2.408  -0.007  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.706  -1.210   0.007  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.711  -0.080   0.005  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.314   1.148   0.000  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.027   1.521  -0.002  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.757   2.706  -0.005  1.00  0.00           O  
HETATM   22  H   UNL     1       5.283   2.192   0.868  1.00  0.00           H  
HETATM   23  H   UNL     1       5.665  -0.641  -0.015  1.00  0.00           H  
HETATM   24  H   UNL     1       4.085  -2.518  -0.006  1.00  0.00           H  
HETATM   25  H   UNL     1       2.421   2.138  -0.011  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.711  -3.586   1.038  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.577  -3.378  -0.502  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.849  -3.805  -0.504  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.283   2.787  -1.029  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.965   2.955   0.607  1.00  0.00           H  
HETATM   31  H   UNL     1       0.754   2.544   0.397  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.895  -1.828  -0.872  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.892  -1.823   0.888  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.768  -0.302   0.007  1.00  0.00           H  
HETATM   35  H   UNL     1       1.300  -3.082   0.003  1.00  0.00           H  
CONECT    1    2    3    3    7                                       
CONECT    2    1   22                                                 
CONECT    3    1    1    4   23                                       
CONECT    4    3    5    5   24                                       
CONECT    5    4    4    6    8                                       
CONECT    6    5    7    7   10                                       
CONECT    7    1    6    6   25                                       
CONECT    8    5    9   35                                            
CONECT    9    8   10   10   11                                       
CONECT   10    6    9    9   15                                       
CONECT   11    9   12   13   13                                       
CONECT   12   11   26   27   28                                       
CONECT   13   11   11   14   17                                       
CONECT   14   13   15   15   20                                       
CONECT   15   10   14   14   16                                       
CONECT   16   15   29   30   31                                       
CONECT   17   13   18   32   33                                       
CONECT   18   17   19   19   34                                       
CONECT   19   18   18   20                                            
CONECT   20   14   19   21   21                                       
CONECT   21   20   20                                                 
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    4                                                      
CONECT   25    7                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
CONECT   28   12                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35    8                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
