COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.680   0.173   1.057  1.00  0.00           N  
HETATM    2  C   UNL     1       4.061  -1.499  -0.652  1.00  0.00           C  
HETATM    3  C   UNL     1       4.553  -0.554   0.239  1.00  0.00           C  
HETATM    4  C   UNL     1       2.399   0.355   0.681  1.00  0.00           C  
HETATM    5  C   UNL     1       1.427   1.026   1.617  1.00  0.00           C  
HETATM    6  C   UNL     1       0.072   1.106   0.962  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.501   2.283  -0.412  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.324  -0.802   0.058  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.222  -2.550  -1.439  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.333  -1.687   0.819  1.00  0.00           C  
HETATM   11 CL   UNL     1      -1.915   3.669  -1.372  1.00  0.00          Cl  
HETATM   12  C   UNL     1      -0.258   2.206   0.192  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.416   1.260  -0.246  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.084   0.152   0.522  1.00  0.00           C  
HETATM   15  N   UNL     1      -3.005  -0.884   0.692  1.00  0.00           N  
HETATM   16  O   UNL     1      -6.111  -0.897   1.720  1.00  0.00           O  
HETATM   17  C   UNL     1      -6.230  -2.283  -0.294  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.254  -1.350  -1.378  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.835   0.078   1.127  1.00  0.00           C  
HETATM   20  O   UNL     1       2.028  -0.021  -0.411  1.00  0.00           O  
HETATM   21  C   UNL     1       5.928  -0.340   0.306  1.00  0.00           C  
HETATM   22  C   UNL     1       6.505   0.675   1.259  1.00  0.00           C  
HETATM   23  N   UNL     1       4.880  -2.188  -1.421  1.00  0.00           N  
HETATM   24  C   UNL     1       6.187  -2.013  -1.377  1.00  0.00           C  
HETATM   25  C   UNL     1       6.751  -1.083  -0.523  1.00  0.00           C  
HETATM   26  H   UNL     1       3.997   0.542   1.896  1.00  0.00           H  
HETATM   27  H   UNL     1       2.997  -1.673  -0.712  1.00  0.00           H  
HETATM   28  H   UNL     1       1.352   0.448   2.538  1.00  0.00           H  
HETATM   29  H   UNL     1       1.780   2.031   1.847  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.669   0.232   0.047  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.686  -3.483  -1.266  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.736  -2.579  -2.401  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.814  -2.481   1.357  1.00  0.00           H  
HETATM   34  H   UNL     1       0.455   3.006   0.062  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.387   1.322  -0.714  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.773  -1.658   1.229  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.762  -1.403   2.225  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.988  -1.564  -0.605  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.692  -3.213   0.038  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.564  -0.583  -2.086  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.239  -1.678  -1.603  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.574  -0.783   1.724  1.00  0.00           H  
HETATM   43  H   UNL     1       6.722   0.195   2.213  1.00  0.00           H  
HETATM   44  H   UNL     1       7.425   1.083   0.841  1.00  0.00           H  
HETATM   45  H   UNL     1       5.787   1.480   1.411  1.00  0.00           H  
HETATM   46  H   UNL     1       6.824  -2.598  -2.023  1.00  0.00           H  
HETATM   47  H   UNL     1       7.822  -0.947  -0.495  1.00  0.00           H  
CONECT    1    3    4   26                                            
CONECT    2   23    3    3   27                                       
CONECT    3    2    2   21    1                                       
CONECT    4    1   20   20    5                                       
CONECT    5    4    6   28   29                                       
CONECT    6    5   12   12   19                                       
CONECT    7   12   11   13   13                                       
CONECT    8   10   15   18   30                                       
CONECT    9   17   18   31   32                                       
CONECT   10   16    8   17   33                                       
CONECT   11    7                                                      
CONECT   12    6    6    7   34                                       
CONECT   13    7    7   14   35                                       
CONECT   14   19   19   13   15                                       
CONECT   15   14    8   36                                            
CONECT   16   10   37                                                 
CONECT   17   10    9   38   39                                       
CONECT   18    8    9   40   41                                       
CONECT   19    6   14   14   42                                       
CONECT   20    4    4                                                 
CONECT   21   25   25    3   22                                       
CONECT   22   21   43   44   45                                       
CONECT   23   24   24    2                                            
CONECT   24   23   23   25   46                                       
CONECT   25   24   21   21   47                                       
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
