COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.445  -0.199   0.300  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.773  -0.223  -0.098  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.478   0.960  -0.222  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.859   2.166   0.050  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.535   2.193   0.446  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.827   1.013   0.573  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.384   1.043   1.006  1.00  0.00           C  
HETATM    8  N   UNL     1       1.114   0.797  -0.810  1.00  0.00           N  
HETATM    9  N   UNL     1       2.985  -0.420  -0.110  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.179   0.908  -0.023  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.289   0.768  -1.231  1.00  0.00           C  
HETATM   12  C   UNL     1       1.745  -0.363  -0.491  1.00  0.00           C  
HETATM   13  C   UNL     1       0.966  -1.650  -0.584  1.00  0.00           C  
HETATM   14  C   UNL     1       1.865  -2.820  -0.182  1.00  0.00           C  
HETATM   15  C   UNL     1       1.086  -4.107  -0.274  1.00  0.00           C  
HETATM   16  C   UNL     1       3.748   0.697  -0.002  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.689   1.020   1.081  1.00  0.00           O  
HETATM   18  N   UNL     1      -2.519   0.908  -0.169  1.00  0.00           N  
HETATM   19  O   UNL     1      -4.752  -1.360   0.429  1.00  0.00           O  
HETATM   20  C   UNL     1      -5.454  -2.570   0.137  1.00  0.00           C  
HETATM   21  C   UNL     1       1.771   1.979  -0.748  1.00  0.00           C  
HETATM   22  O   UNL     1       1.219   3.025  -1.035  1.00  0.00           O  
HETATM   23  C   UNL     1       3.178   1.949  -0.319  1.00  0.00           C  
HETATM   24  C   UNL     1       3.941   3.110  -0.216  1.00  0.00           C  
HETATM   25  C   UNL     1       5.253   3.027   0.197  1.00  0.00           C  
HETATM   26  C   UNL     1       5.817   1.798   0.510  1.00  0.00           C  
HETATM   27  C   UNL     1       5.080   0.637   0.414  1.00  0.00           C  
HETATM   28 CL   UNL     1       5.803  -0.891   0.810  1.00  0.00          Cl  
HETATM   29  O   UNL     1       1.676  -5.273   0.033  1.00  0.00           O  
HETATM   30  O   UNL     1      -0.070  -4.089  -0.626  1.00  0.00           O  
HETATM   31  H   UNL     1      -7.257  -1.165  -0.311  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.512   0.941  -0.533  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.412   3.089  -0.048  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.054   3.136   0.658  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.173   1.990   1.504  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.194   0.220   1.694  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.479   1.592  -1.919  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.499  -0.178  -1.730  1.00  0.00           H  
HETATM   39  H   UNL     1       0.108  -1.604   0.087  1.00  0.00           H  
HETATM   40  H   UNL     1       0.620  -1.792  -1.607  1.00  0.00           H  
HETATM   41  H   UNL     1       2.724  -2.866  -0.852  1.00  0.00           H  
HETATM   42  H   UNL     1       2.211  -2.678   0.842  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.910   0.817  -1.052  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.309  -2.664   0.806  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.801  -2.549  -0.896  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.787  -3.421   0.279  1.00  0.00           H  
HETATM   47  H   UNL     1       3.507   4.069  -0.458  1.00  0.00           H  
HETATM   48  H   UNL     1       5.847   3.925   0.278  1.00  0.00           H  
HETATM   49  H   UNL     1       6.847   1.750   0.832  1.00  0.00           H  
HETATM   50  H   UNL     1       1.136  -6.071  -0.041  1.00  0.00           H  
CONECT    1    6   19    2    2                                       
CONECT    2    1    1    3   31                                       
CONECT    3    4    4    2   32                                       
CONECT    4    5    3    3   33                                       
CONECT    5    6    6    4   34                                       
CONECT    6    7    5    5    1                                       
CONECT    7   18    6   35   36                                       
CONECT    8   12   21   11                                            
CONECT    9   16   12   12                                            
CONECT   10   11   17   17   18                                       
CONECT   11    8   10   37   38                                       
CONECT   12    9    9    8   13                                       
CONECT   13   12   14   39   40                                       
CONECT   14   15   13   41   42                                       
CONECT   15   30   30   14   29                                       
CONECT   16   27   27   23    9                                       
CONECT   17   10   10                                                 
CONECT   18   10    7   43                                            
CONECT   19   20    1                                                 
CONECT   20   19   44   45   46                                       
CONECT   21   23    8   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   24   24   16   21                                       
CONECT   24   25   23   23   47                                       
CONECT   25   26   26   24   48                                       
CONECT   26   25   25   27   49                                       
CONECT   27   28   26   16   16                                       
CONECT   28   27                                                      
CONECT   29   15   50                                                 
CONECT   30   15   15                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
