COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.209   1.196  -1.785  1.00  0.00           C  
HETATM    2  C   UNL     1       3.068   0.572  -2.264  1.00  0.00           C  
HETATM    3  C   UNL     1       2.246  -0.127  -1.409  1.00  0.00           C  
HETATM    4  C   UNL     1       2.561  -0.211  -0.048  1.00  0.00           C  
HETATM    5  C   UNL     1       1.684  -0.958   0.871  1.00  0.00           C  
HETATM    6  C   UNL     1       0.407  -1.524   0.379  1.00  0.00           C  
HETATM    7  C   UNL     1       0.357  -2.853  -0.041  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.843  -3.374  -0.500  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.956  -2.552  -0.524  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.839  -1.230  -0.089  1.00  0.00           C  
HETATM   11  C   UNL     1       3.715   0.420   0.436  1.00  0.00           C  
HETATM   12  F   UNL     1      -1.687   1.513   0.544  1.00  0.00           F  
HETATM   13  C   UNL     1      -2.895   1.009   0.211  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.010   1.835   0.183  1.00  0.00           C  
HETATM   15  O   UNL     1      -3.887   3.154   0.491  1.00  0.00           O  
HETATM   16  C   UNL     1      -5.249   1.316  -0.160  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.380  -0.025  -0.475  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.277  -0.855  -0.450  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.026  -0.341  -0.112  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.680  -0.763   0.348  1.00  0.00           N  
HETATM   21  O   UNL     1       2.009  -1.110   2.032  1.00  0.00           O  
HETATM   22  O   UNL     1       4.031   0.346   1.754  1.00  0.00           O  
HETATM   23  C   UNL     1       4.538   1.118  -0.443  1.00  0.00           C  
HETATM   24  O   UNL     1       5.660   1.733   0.019  1.00  0.00           O  
HETATM   25  H   UNL     1       4.847   1.742  -2.464  1.00  0.00           H  
HETATM   26  H   UNL     1       2.822   0.635  -3.314  1.00  0.00           H  
HETATM   27  H   UNL     1       1.357  -0.610  -1.789  1.00  0.00           H  
HETATM   28  H   UNL     1       1.244  -3.468  -0.010  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.908  -4.400  -0.831  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.905  -2.928  -0.876  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.694   3.719  -0.269  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.116   1.960  -0.182  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.347  -0.424  -0.741  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.383  -1.901  -0.695  1.00  0.00           H  
HETATM   35  H   UNL     1       4.588  -0.410   1.983  1.00  0.00           H  
HETATM   36  H   UNL     1       6.449   1.174   0.003  1.00  0.00           H  
CONECT    1   23   23    2   25                                       
CONECT    2    3    3    1   26                                       
CONECT    3    4    2    2   27                                       
CONECT    4    5   11   11    3                                       
CONECT    5   21   21    6    4                                       
CONECT    6    5    7   20   20                                       
CONECT    7    8    8    6   28                                       
CONECT    8    7    7    9   29                                       
CONECT    9    8   10   10   30                                       
CONECT   10   20    9    9   19                                       
CONECT   11   22    4    4   23                                       
CONECT   12   13                                                      
CONECT   13   12   14   14   19                                       
CONECT   14   15   13   13   16                                       
CONECT   15   14   31                                                 
CONECT   16   14   17   17   32                                       
CONECT   17   16   16   18   33                                       
CONECT   18   19   19   17   34                                       
CONECT   19   13   10   18   18                                       
CONECT   20    6    6   10                                            
CONECT   21    5    5                                                 
CONECT   22   11   35                                                 
CONECT   23   11   24    1    1                                       
CONECT   24   23   36                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   22                                                      
CONECT   36   24                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
