COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.328   3.424  -1.985  1.00  0.00           C  
HETATM    2  N   UNL     1       6.159   2.257  -1.116  1.00  0.00           N  
HETATM    3  C   UNL     1       7.280   1.782  -0.302  1.00  0.00           C  
HETATM    4  C   UNL     1       4.972   1.620  -1.066  1.00  0.00           C  
HETATM    5  O   UNL     1       4.076   1.947  -1.819  1.00  0.00           O  
HETATM    6  C   UNL     1       4.762   0.524  -0.097  1.00  0.00           C  
HETATM    7  C   UNL     1       5.361   0.578   1.163  1.00  0.00           C  
HETATM    8  C   UNL     1       5.160  -0.447   2.063  1.00  0.00           C  
HETATM    9  C   UNL     1       4.366  -1.528   1.720  1.00  0.00           C  
HETATM   10  C   UNL     1       3.769  -1.587   0.474  1.00  0.00           C  
HETATM   11  C   UNL     1       2.907  -2.768   0.109  1.00  0.00           C  
HETATM   12  N   UNL     1       1.519  -2.495   0.490  1.00  0.00           N  
HETATM   13  C   UNL     1       0.449  -2.550  -0.328  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.653  -2.229   0.411  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.051  -2.164  -0.082  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.709  -3.312  -0.534  1.00  0.00           C  
HETATM   17 CL   UNL     1      -1.899  -4.847  -0.527  1.00  0.00          Cl  
HETATM   18  C   UNL     1      -4.012  -3.211  -0.985  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.649  -2.058  -1.000  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.072  -0.931  -0.582  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.501   0.346  -0.498  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.547   1.105  -0.012  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.653   2.560   0.221  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.669   3.380   0.729  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.171   4.628   0.780  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.462   5.818   1.257  1.00  0.00           C  
HETATM   27  N   UNL     1      -4.485   4.595   0.300  1.00  0.00           N  
HETATM   28  C   UNL     1      -4.779   3.370  -0.041  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.092   2.901  -0.612  1.00  0.00           C  
HETATM   30  N   UNL     1      -2.439   0.345   0.245  1.00  0.00           N  
HETATM   31  C   UNL     1      -2.751  -0.954  -0.103  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.221  -1.971   1.727  1.00  0.00           C  
HETATM   33  N   UNL     1       1.074  -2.137   1.769  1.00  0.00           N  
HETATM   34  C   UNL     1       3.958  -0.565  -0.434  1.00  0.00           C  
HETATM   35  H   UNL     1       6.668   3.099  -2.968  1.00  0.00           H  
HETATM   36  H   UNL     1       5.376   3.945  -2.083  1.00  0.00           H  
HETATM   37  H   UNL     1       7.067   4.097  -1.550  1.00  0.00           H  
HETATM   38  H   UNL     1       7.311   2.339   0.635  1.00  0.00           H  
HETATM   39  H   UNL     1       7.150   0.720  -0.089  1.00  0.00           H  
HETATM   40  H   UNL     1       8.213   1.932  -0.845  1.00  0.00           H  
HETATM   41  H   UNL     1       5.981   1.420   1.432  1.00  0.00           H  
HETATM   42  H   UNL     1       3.488  -0.611  -1.405  1.00  0.00           H  
HETATM   43  H   UNL     1       5.623  -0.407   3.038  1.00  0.00           H  
HETATM   44  H   UNL     1       4.213  -2.328   2.429  1.00  0.00           H  
HETATM   45  H   UNL     1       2.961  -2.939  -0.966  1.00  0.00           H  
HETATM   46  H   UNL     1       3.261  -3.653   0.636  1.00  0.00           H  
HETATM   47  H   UNL     1       0.462  -2.802  -1.378  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.852  -1.690   2.558  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.520  -4.098  -1.334  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.596   0.658   0.608  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.677   3.078   1.031  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.943   6.290   0.423  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.177   6.520   1.684  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.737   5.529   2.019  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.758   2.610   0.200  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.549   3.709  -1.184  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.920   2.046  -1.265  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    1    3    4                                            
CONECT    3    2   38   39   40                                       
CONECT    4    2    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    7   34   34                                       
CONECT    7    6    8    8   41                                       
CONECT    8    7    7    9   43                                       
CONECT    9    8   10   10   44                                       
CONECT   10    9    9   11   34                                       
CONECT   11   10   12   45   46                                       
CONECT   12   11   13   33                                            
CONECT   13   12   14   14   47                                       
CONECT   14   13   13   15   32                                       
CONECT   15   14   16   31   31                                       
CONECT   16   15   17   18   18                                       
CONECT   17   16                                                      
CONECT   18   16   16   19   49                                       
CONECT   19   18   20   20                                            
CONECT   20   19   19   21   31                                       
CONECT   21   20   22   22                                            
CONECT   22   21   21   23   30                                       
CONECT   23   22   24   24   28                                       
CONECT   24   23   23   25   51                                       
CONECT   25   24   26   27                                            
CONECT   26   25   52   53   54                                       
CONECT   27   25   28   28                                            
CONECT   28   23   27   27   29                                       
CONECT   29   28   55   56   57                                       
CONECT   30   22   31   50                                            
CONECT   31   15   15   20   30                                       
CONECT   32   14   33   33   48                                       
CONECT   33   12   32   32                                            
CONECT   34    6    6   10   42                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    7                                                      
CONECT   42   34                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   32                                                      
CONECT   49   18                                                      
CONECT   50   30                                                      
CONECT   51   24                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
