COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.098   0.895   1.228  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.007  -0.593   1.598  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.852  -1.177   0.461  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.785  -1.988  -0.689  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.580   2.296  -0.164  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.270   1.708  -0.451  1.00  0.00           C  
HETATM    7  C   UNL     1       1.618   0.620  -0.290  1.00  0.00           C  
HETATM    8  C   UNL     1       3.471  -0.928   0.184  1.00  0.00           C  
HETATM    9  C   UNL     1       4.933  -1.075  -0.153  1.00  0.00           C  
HETATM   10  C   UNL     1       5.891  -0.501   0.661  1.00  0.00           C  
HETATM   11  C   UNL     1       7.614  -1.345  -0.773  1.00  0.00           C  
HETATM   12  C   UNL     1       5.315  -1.789  -1.273  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.917  -1.414   0.435  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.092  -3.209  -1.298  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.143  -2.404  -0.118  1.00  0.00           C  
HETATM   16  O   UNL     1      -6.944  -2.969  -1.157  1.00  0.00           O  
HETATM   17  N   UNL     1      -4.654  -0.326   1.092  1.00  0.00           N  
HETATM   18  O   UNL     1      -4.690   1.768   1.834  1.00  0.00           O  
HETATM   19  C   UNL     1      -2.769   1.170   0.647  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.705   0.311   0.906  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.340   2.560  -0.711  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.164   3.651  -1.502  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.306   4.481  -1.726  1.00  0.00           C  
HETATM   24  O   UNL     1       1.028   1.700  -0.831  1.00  0.00           O  
HETATM   25  C   UNL     1      -0.453   0.576   0.356  1.00  0.00           C  
HETATM   26  N   UNL     1       0.753  -0.056   0.421  1.00  0.00           N  
HETATM   27  N   UNL     1       2.941   0.277  -0.457  1.00  0.00           N  
HETATM   28  C   UNL     1       7.233  -0.635   0.351  1.00  0.00           C  
HETATM   29 CL   UNL     1       8.436   0.093   1.368  1.00  0.00          Cl  
HETATM   30  C   UNL     1       6.655  -1.924  -1.583  1.00  0.00           C  
HETATM   31  H   UNL     1      -6.457   0.336   1.947  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.955  -1.306   2.421  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.828  -1.469   0.846  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.978  -0.427  -0.320  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.931  -1.231  -1.460  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.409   2.958  -0.367  1.00  0.00           H  
HETATM   37  H   UNL     1       2.926  -1.801  -0.175  1.00  0.00           H  
HETATM   38  H   UNL     1       3.355  -0.846   1.265  1.00  0.00           H  
HETATM   39  H   UNL     1       5.592   0.054   1.538  1.00  0.00           H  
HETATM   40  H   UNL     1       8.661  -1.450  -1.016  1.00  0.00           H  
HETATM   41  H   UNL     1       4.567  -2.242  -1.906  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.695  -2.196   1.161  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.988  -1.026   0.017  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.947  -3.966  -0.527  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.710  -3.617  -2.097  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.124  -2.913  -1.702  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.995  -3.142   0.669  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.821  -3.256  -0.867  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.850  -0.558   1.532  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.668   4.866  -0.773  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.029   5.314  -2.373  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.092   3.896  -2.204  1.00  0.00           H  
HETATM   53  H   UNL     1       3.522   0.834  -0.999  1.00  0.00           H  
HETATM   54  H   UNL     1       6.953  -2.478  -2.461  1.00  0.00           H  
CONECT    1   17   18   18   19                                       
CONECT    2    3   17   31   32                                       
CONECT    3   15    2   33   34                                       
CONECT    4   14   15   13   35                                       
CONECT    5   19   21   21   36                                       
CONECT    6   25   25   21   24                                       
CONECT    7   26   26   24   27                                       
CONECT    8    9   27   37   38                                       
CONECT    9   12   10   10    8                                       
CONECT   10   28    9    9   39                                       
CONECT   11   28   28   30   40                                       
CONECT   12   30   30    9   41                                       
CONECT   13    4   17   42   43                                       
CONECT   14    4   44   45   46                                       
CONECT   15   16    4    3   47                                       
CONECT   16   15   48                                                 
CONECT   17   13    2    1                                            
CONECT   18    1    1                                                 
CONECT   19    1   20   20    5                                       
CONECT   20   19   19   25   49                                       
CONECT   21    5    5    6   22                                       
CONECT   22   21   23                                                 
CONECT   23   22   50   51   52                                       
CONECT   24    6    7                                                 
CONECT   25   20   26    6    6                                       
CONECT   26   25    7    7                                            
CONECT   27    7    8   53                                            
CONECT   28   29   11   11   10                                       
CONECT   29   28                                                      
CONECT   30   11   12   12   54                                       
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   20                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   27                                                      
CONECT   54   30                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
