COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.272   2.234  -1.854  1.00  0.00           N  
HETATM    2  C   UNL     1       4.158  -2.236   0.533  1.00  0.00           C  
HETATM    3  C   UNL     1       2.945  -2.240  -0.135  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.061   1.838  -0.179  1.00  0.00           N  
HETATM    5  C   UNL     1       2.442  -1.071  -0.666  1.00  0.00           C  
HETATM    6  O   UNL     1      -1.281   3.385   2.078  1.00  0.00           O  
HETATM    7  C   UNL     1       1.264   1.905  -0.927  1.00  0.00           C  
HETATM    8  C   UNL     1       4.380   0.118   0.143  1.00  0.00           C  
HETATM    9  C   UNL     1       4.874  -1.060   0.672  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.190   4.490   2.315  1.00  0.00           N  
HETATM   11  C   UNL     1       3.157   0.118  -0.530  1.00  0.00           C  
HETATM   12  C   UNL     1       2.621   1.378  -1.099  1.00  0.00           C  
HETATM   13  C   UNL     1       1.215   3.092  -1.629  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.467   3.459   1.835  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.131   2.398   0.997  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.121   1.295   0.674  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.818   0.169  -0.045  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.079   0.271  -1.399  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.718  -0.761  -2.060  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.098  -1.897  -1.366  1.00  0.00           C  
HETATM   21  F   UNL     1      -4.722  -2.906  -2.011  1.00  0.00           F  
HETATM   22  C   UNL     1      -3.836  -1.999  -0.009  1.00  0.00           C  
HETATM   23 CL   UNL     1      -4.310  -3.423   0.863  1.00  0.00          Cl  
HETATM   24  C   UNL     1      -3.191  -0.967   0.649  1.00  0.00           C  
HETATM   25  C   UNL     1       0.169   1.289  -0.158  1.00  0.00           C  
HETATM   26  O   UNL     1       0.376   0.285   0.498  1.00  0.00           O  
HETATM   27  N   UNL     1       2.419   3.290  -2.186  1.00  0.00           N  
HETATM   28 CL   UNL     1       4.781  -3.711   1.205  1.00  0.00          Cl  
HETATM   29  F   UNL     1       5.078   1.266   0.278  1.00  0.00           F  
HETATM   30  H   UNL     1       2.661   4.052  -2.736  1.00  0.00           H  
HETATM   31  H   UNL     1       2.391  -3.162  -0.240  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.246   2.592  -0.761  1.00  0.00           H  
HETATM   33  H   UNL     1       1.496  -1.076  -1.186  1.00  0.00           H  
HETATM   34  H   UNL     1       5.820  -1.062   1.193  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.762   5.173   2.854  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.138   4.549   2.120  1.00  0.00           H  
HETATM   37  H   UNL     1       0.359   3.744  -1.715  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.970   1.972   1.548  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.493   2.841   0.069  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.685   0.920   1.600  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.783   1.157  -1.940  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.922  -0.680  -3.117  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.983  -1.047   1.706  1.00  0.00           H  
CONECT    1   12   12   27                                            
CONECT    2   28    9    9    3                                       
CONECT    3    2    5    5   31                                       
CONECT    4   16   25   32                                            
CONECT    5    3    3   11   33                                       
CONECT    6   14   14                                                 
CONECT    7   25   12   13   13                                       
CONECT    8    9   29   11   11                                       
CONECT    9    2    2    8   34                                       
CONECT   10   14   35   36                                            
CONECT   11    8    8    5   12                                       
CONECT   12   11    7    1    1                                       
CONECT   13    7    7   27   37                                       
CONECT   14    6    6   15   10                                       
CONECT   15   14   16   38   39                                       
CONECT   16   15   17    4   40                                       
CONECT   17   18   16   24   24                                       
CONECT   18   19   19   17   41                                       
CONECT   19   18   18   20   42                                       
CONECT   20   19   21   22   22                                       
CONECT   21   20                                                      
CONECT   22   20   20   24   23                                       
CONECT   23   22                                                      
CONECT   24   17   17   22   43                                       
CONECT   25   26   26    4    7                                       
CONECT   26   25   25                                                 
CONECT   27    1   13   30                                            
CONECT   28    2                                                      
CONECT   29    8                                                      
CONECT   30   27                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   13                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
