COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -6.324   0.097   0.519  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -4.589   0.067   0.562  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.867   1.093  -0.024  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.488   1.075   0.007  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.932  -0.979   1.188  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.554  -1.007   1.226  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.821   0.020   0.632  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.341  -0.005   0.668  1.00  0.00           C  
HETATM    9  N   UNL     1       0.189  -0.682   1.627  1.00  0.00           N  
HETATM   10  C   UNL     1       0.343   0.740  -0.395  1.00  0.00           C  
HETATM   11  C   UNL     1       1.469   1.533  -0.166  1.00  0.00           C  
HETATM   12  C   UNL     1       2.037   2.251  -1.214  1.00  0.00           C  
HETATM   13  C   UNL     1       1.517   2.163  -2.487  1.00  0.00           C  
HETATM   14  C   UNL     1       0.414   1.354  -2.731  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.090   1.255  -3.990  1.00  0.00           O  
HETATM   16  C   UNL     1       0.563   2.011  -5.012  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.170   0.649  -1.698  1.00  0.00           C  
HETATM   18  N   UNL     1       2.080   1.596   1.087  1.00  0.00           N  
HETATM   19  C   UNL     1       2.216   0.569   1.963  1.00  0.00           C  
HETATM   20  N   UNL     1       2.892   1.012   2.983  1.00  0.00           N  
HETATM   21  N   UNL     1       3.159   2.261   2.815  1.00  0.00           N  
HETATM   22  C   UNL     1       2.674   2.670   1.672  1.00  0.00           C  
HETATM   23  C   UNL     1       2.756   4.066   1.110  1.00  0.00           C  
HETATM   24  C   UNL     1       1.643  -0.817   1.770  1.00  0.00           C  
HETATM   25  C   UNL     1       2.232  -1.448   0.506  1.00  0.00           C  
HETATM   26  C   UNL     1       1.717  -2.857   0.361  1.00  0.00           C  
HETATM   27  O   UNL     1       0.954  -3.312   1.188  1.00  0.00           O  
HETATM   28  N   UNL     1       2.104  -3.612  -0.686  1.00  0.00           N  
HETATM   29  C   UNL     1       1.603  -4.982  -0.826  1.00  0.00           C  
HETATM   30  C   UNL     1       2.192  -5.613  -2.090  1.00  0.00           C  
HETATM   31  H   UNL     1      -4.384   1.909  -0.507  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.925   1.875  -0.451  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.501  -1.774   1.648  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.043  -1.824   1.714  1.00  0.00           H  
HETATM   35  H   UNL     1       2.893   2.882  -1.028  1.00  0.00           H  
HETATM   36  H   UNL     1       1.965   2.723  -3.295  1.00  0.00           H  
HETATM   37  H   UNL     1       1.604   1.696  -5.088  1.00  0.00           H  
HETATM   38  H   UNL     1       0.062   1.842  -5.965  1.00  0.00           H  
HETATM   39  H   UNL     1       0.522   3.071  -4.762  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.028   0.024  -1.894  1.00  0.00           H  
HETATM   41  H   UNL     1       1.944   4.670   1.516  1.00  0.00           H  
HETATM   42  H   UNL     1       3.713   4.512   1.384  1.00  0.00           H  
HETATM   43  H   UNL     1       2.672   4.026   0.024  1.00  0.00           H  
HETATM   44  H   UNL     1       1.873  -1.439   2.635  1.00  0.00           H  
HETATM   45  H   UNL     1       1.936  -0.862  -0.364  1.00  0.00           H  
HETATM   46  H   UNL     1       3.319  -1.465   0.581  1.00  0.00           H  
HETATM   47  H   UNL     1       2.714  -3.248  -1.347  1.00  0.00           H  
HETATM   48  H   UNL     1       1.899  -5.567   0.044  1.00  0.00           H  
HETATM   49  H   UNL     1       0.516  -4.965  -0.901  1.00  0.00           H  
HETATM   50  H   UNL     1       1.819  -6.631  -2.194  1.00  0.00           H  
HETATM   51  H   UNL     1       1.897  -5.027  -2.960  1.00  0.00           H  
HETATM   52  H   UNL     1       3.279  -5.629  -2.015  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    3    5                                       
CONECT    3    2    2    4   31                                       
CONECT    4    3    7    7   32                                       
CONECT    5    2    6    6   33                                       
CONECT    6    5    5    7   34                                       
CONECT    7    4    4    6    8                                       
CONECT    8    7    9    9   10                                       
CONECT    9    8    8   24                                            
CONECT   10    8   11   11   17                                       
CONECT   11   10   10   12   18                                       
CONECT   12   11   13   13   35                                       
CONECT   13   12   12   14   36                                       
CONECT   14   13   15   17   17                                       
CONECT   15   14   16                                                 
CONECT   16   15   37   38   39                                       
CONECT   17   10   14   14   40                                       
CONECT   18   11   19   22                                            
CONECT   19   18   20   20   24                                       
CONECT   20   19   19   21                                            
CONECT   21   20   22   22                                            
CONECT   22   18   21   21   23                                       
CONECT   23   22   41   42   43                                       
CONECT   24    9   19   25   44                                       
CONECT   25   24   26   45   46                                       
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   29   47                                            
CONECT   29   28   30   48   49                                       
CONECT   30   29   50   51   52                                       
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   30                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
