COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.340  -0.490  -0.871  1.00  0.00           C  
HETATM    2  N   UNL     1       9.079   0.162  -0.508  1.00  0.00           N  
HETATM    3  C   UNL     1       7.917  -0.515  -0.607  1.00  0.00           C  
HETATM    4  O   UNL     1       7.916  -1.667  -0.997  1.00  0.00           O  
HETATM    5  C   UNL     1       6.658   0.137  -0.245  1.00  0.00           C  
HETATM    6  C   UNL     1       5.495  -0.540  -0.344  1.00  0.00           C  
HETATM    7  C   UNL     1       4.229   0.116   0.020  1.00  0.00           C  
HETATM    8  C   UNL     1       3.026  -0.578  -0.080  1.00  0.00           C  
HETATM    9  C   UNL     1       1.846   0.096   0.281  1.00  0.00           C  
HETATM   10  C   UNL     1       0.595  -0.539   0.206  1.00  0.00           C  
HETATM   11  C   UNL     1       4.224   1.448   0.478  1.00  0.00           C  
HETATM   12  N   UNL     1       3.113   2.053   0.808  1.00  0.00           N  
HETATM   13  C   UNL     1       1.926   1.440   0.727  1.00  0.00           C  
HETATM   14  C   UNL     1       0.746   2.111   1.087  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.452   1.470   1.004  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.531   0.146   0.565  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.742  -0.468   0.494  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.892   0.335   0.766  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.135   0.382   2.276  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.095  -0.263   0.083  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.970   0.550  -0.613  1.00  0.00           C  
HETATM   22 CL   UNL     1      -4.684   2.260  -0.699  1.00  0.00          Cl  
HETATM   23  C   UNL     1      -6.076   0.000  -1.242  1.00  0.00           C  
HETATM   24  F   UNL     1      -6.932   0.794  -1.922  1.00  0.00           F  
HETATM   25  C   UNL     1      -6.303  -1.364  -1.173  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.427  -2.176  -0.477  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.320  -1.627   0.147  1.00  0.00           C  
HETATM   28 CL   UNL     1      -3.217  -2.649   1.014  1.00  0.00          Cl  
HETATM   29  H   UNL     1      11.164   0.207  -0.727  1.00  0.00           H  
HETATM   30  H   UNL     1      10.490  -1.366  -0.239  1.00  0.00           H  
HETATM   31  H   UNL     1      10.302  -0.798  -1.916  1.00  0.00           H  
HETATM   32  H   UNL     1       9.080   1.081  -0.197  1.00  0.00           H  
HETATM   33  H   UNL     1       6.659   1.160   0.101  1.00  0.00           H  
HETATM   34  H   UNL     1       5.494  -1.563  -0.690  1.00  0.00           H  
HETATM   35  H   UNL     1       2.999  -1.601  -0.424  1.00  0.00           H  
HETATM   36  H   UNL     1       0.525  -1.562  -0.133  1.00  0.00           H  
HETATM   37  H   UNL     1       5.160   1.981   0.559  1.00  0.00           H  
HETATM   38  H   UNL     1       0.788   3.135   1.429  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.355   1.993   1.282  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.727   1.345   0.393  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.265   0.814   2.771  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.013   0.994   2.484  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.300  -0.629   2.650  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.164  -1.793  -1.662  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.604  -3.240  -0.423  1.00  0.00           H  
CONECT    1    2   29   30   31                                       
CONECT    2    1    3   32                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6    6   33                                       
CONECT    6    5    5    7   34                                       
CONECT    7    6    8    8   11                                       
CONECT    8    7    7    9   35                                       
CONECT    9    8   10   10   13                                       
CONECT   10    9    9   16   36                                       
CONECT   11    7   12   12   37                                       
CONECT   12   11   11   13                                            
CONECT   13    9   12   14   14                                       
CONECT   14   13   13   15   38                                       
CONECT   15   14   16   16   39                                       
CONECT   16   10   15   15   17                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   20   40                                       
CONECT   19   18   41   42   43                                       
CONECT   20   18   21   21   27                                       
CONECT   21   20   20   22   23                                       
CONECT   22   21                                                      
CONECT   23   21   24   25   25                                       
CONECT   24   23                                                      
CONECT   25   23   23   26   44                                       
CONECT   26   25   27   27   45                                       
CONECT   27   20   26   26   28                                       
CONECT   28   27                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
