COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.569  -0.112   0.079  1.00  0.00           C  
HETATM    2  C   UNL     1       5.502   1.454   0.198  1.00  0.00           C  
HETATM    3  C   UNL     1       6.014   2.735   0.211  1.00  0.00           C  
HETATM    4  C   UNL     1       5.166   3.825   0.125  1.00  0.00           C  
HETATM    5  C   UNL     1       3.271   2.362   0.012  1.00  0.00           C  
HETATM    6  C   UNL     1       3.944  -2.433   0.143  1.00  0.00           C  
HETATM    7  C   UNL     1       1.697  -1.480  -0.028  1.00  0.00           C  
HETATM    8  C   UNL     1       3.799   3.639   0.026  1.00  0.00           C  
HETATM    9  C   UNL     1       4.124   1.257   0.098  1.00  0.00           C  
HETATM   10  N   UNL     1       4.426  -1.171   0.159  1.00  0.00           N  
HETATM   11  N   UNL     1       2.271  -0.267  -0.010  1.00  0.00           N  
HETATM   12  C   UNL     1      -8.486   0.294   1.416  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.292   0.469   0.523  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.915   0.588   0.663  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.125   0.640  -0.471  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.627   0.768  -0.362  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.998  -0.626  -0.306  1.00  0.00           C  
HETATM   18  C   UNL     1       0.226  -1.606  -0.136  1.00  0.00           C  
HETATM   19  C   UNL     1       2.492  -2.615   0.038  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.743   0.571  -1.713  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.116   0.453  -1.777  1.00  0.00           C  
HETATM   22  F   UNL     1       1.935   2.182  -0.084  1.00  0.00           F  
HETATM   23  N   UNL     1      -0.543  -0.501  -0.200  1.00  0.00           N  
HETATM   24  N   UNL     1      -6.844   0.400  -0.677  1.00  0.00           N  
HETATM   25  O   UNL     1      -7.078   0.417   1.627  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.289  -2.707  -0.166  1.00  0.00           O  
HETATM   27  O   UNL     1       1.942  -3.855   0.022  1.00  0.00           O  
HETATM   28  O   UNL     1       4.693  -3.392   0.213  1.00  0.00           O  
HETATM   29  H   UNL     1       6.167   0.605   0.261  1.00  0.00           H  
HETATM   30  H   UNL     1       7.080   2.887   0.288  1.00  0.00           H  
HETATM   31  H   UNL     1       5.573   4.825   0.135  1.00  0.00           H  
HETATM   32  H   UNL     1       3.142   4.495  -0.040  1.00  0.00           H  
HETATM   33  H   UNL     1       5.381  -1.018   0.228  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.843   1.150   0.843  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.693  -0.624   0.867  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.996   0.264   2.379  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.468   0.640   1.645  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.244   1.305  -1.230  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.375   1.317   0.545  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.381  -1.162   0.562  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.251  -1.175  -1.213  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.155   0.609  -2.618  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.602   0.399  -2.740  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.132   0.378  -0.176  1.00  0.00           H  
HETATM   45  H   UNL     1       2.588  -4.573   0.073  1.00  0.00           H  
CONECT    1    9   11   11   10                                       
CONECT    2    3    9    9   29                                       
CONECT    3    4    4    2   30                                       
CONECT    4    3    3    8   31                                       
CONECT    5    8    8    9   22                                       
CONECT    6   10   19   28   28                                       
CONECT    7   11   18   19   19                                       
CONECT    8    4    5    5   32                                       
CONECT    9    2    2    5    1                                       
CONECT   10    1    6   33                                            
CONECT   11    1    1    7                                            
CONECT   12   25   34   35   36                                       
CONECT   13   24   24   14   25                                       
CONECT   14   15   15   13   37                                       
CONECT   15   20   16   14   14                                       
CONECT   16   15   17   38   39                                       
CONECT   17   16   23   40   41                                       
CONECT   18   23   26   26    7                                       
CONECT   19    7    7    6   27                                       
CONECT   20   21   21   15   42                                       
CONECT   21   20   20   24   43                                       
CONECT   22    5                                                      
CONECT   23   17   18   44                                            
CONECT   24   21   13   13                                            
CONECT   25   13   12                                                 
CONECT   26   18   18                                                 
CONECT   27   19   45                                                 
CONECT   28    6    6                                                 
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   27                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
