COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.984   3.116   1.107  1.00  0.00           C  
HETATM    2  C   UNL     1       3.981   2.482  -0.285  1.00  0.00           C  
HETATM    3  C   UNL     1       4.050   0.983  -0.155  1.00  0.00           C  
HETATM    4  C   UNL     1       2.991   0.137  -0.061  1.00  0.00           C  
HETATM    5  C   UNL     1       1.576   0.538  -0.071  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.799   0.003   0.020  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.683  -1.240   0.145  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.132  -0.829   0.136  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.773  -0.530   1.325  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.101  -0.153   1.320  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.794  -0.074   0.119  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.672   0.325  -1.258  1.00  0.00           C  
HETATM   13  C   UNL     1      -9.096   0.884  -1.245  1.00  0.00           C  
HETATM   14  C   UNL     1      -9.974   0.008  -0.346  1.00  0.00           C  
HETATM   15  C   UNL     1      -9.370  -0.032   1.061  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.938  -0.565   0.980  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.148  -0.374  -1.074  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.818  -0.745  -1.062  1.00  0.00           C  
HETATM   19  C   UNL     1       4.830  -1.143   0.013  1.00  0.00           C  
HETATM   20  C   UNL     1       5.797  -2.142   0.081  1.00  0.00           C  
HETATM   21  C   UNL     1       7.131  -1.808   0.023  1.00  0.00           C  
HETATM   22  C   UNL     1       7.525  -0.481  -0.102  1.00  0.00           C  
HETATM   23  C   UNL     1       6.595   0.516  -0.173  1.00  0.00           C  
HETATM   24  C   UNL     1       5.231   0.202  -0.114  1.00  0.00           C  
HETATM   25  N   UNL     1       0.610  -0.396   0.029  1.00  0.00           N  
HETATM   26  N   UNL     1      -7.138   0.307   0.110  1.00  0.00           N  
HETATM   27  N   UNL     1       3.455  -1.160   0.043  1.00  0.00           N  
HETATM   28  O   UNL     1       1.278   1.713  -0.168  1.00  0.00           O  
HETATM   29 CL   UNL     1       9.214  -0.087  -0.175  1.00  0.00          Cl  
HETATM   30  H   UNL     1       3.934   4.201   1.013  1.00  0.00           H  
HETATM   31  H   UNL     1       3.122   2.760   1.670  1.00  0.00           H  
HETATM   32  H   UNL     1       4.899   2.839   1.630  1.00  0.00           H  
HETATM   33  H   UNL     1       3.066   2.760  -0.809  1.00  0.00           H  
HETATM   34  H   UNL     1       4.844   2.838  -0.849  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.025   0.517  -0.914  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.993   0.672   0.859  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.489  -1.909  -0.693  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.457  -1.753   1.080  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.233  -0.593   2.258  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.601   0.079   2.249  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.683  -0.690  -1.656  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.040   0.954  -1.885  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.083   1.903  -0.859  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.497   0.882  -2.258  1.00  0.00           H  
HETATM   45  H   UNL     1     -10.979   0.428  -0.299  1.00  0.00           H  
HETATM   46  H   UNL     1     -10.019  -1.002  -0.753  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.362   0.973   1.482  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.968  -0.688   1.694  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.500  -0.582   1.978  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.948  -1.575   0.571  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.685  -0.313  -2.009  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.314  -0.974  -1.989  1.00  0.00           H  
HETATM   53  H   UNL     1       5.501  -3.176   0.179  1.00  0.00           H  
HETATM   54  H   UNL     1       7.879  -2.585   0.077  1.00  0.00           H  
HETATM   55  H   UNL     1       6.909   1.545  -0.270  1.00  0.00           H  
HETATM   56  H   UNL     1       0.848  -1.334   0.107  1.00  0.00           H  
HETATM   57  H   UNL     1       2.902  -1.953   0.123  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    1    3   33   34                                       
CONECT    3    2   24    4    4                                       
CONECT    4    3    3   27    5                                       
CONECT    5    4   25   28   28                                       
CONECT    6   25    7   35   36                                       
CONECT    7    6    8   37   38                                       
CONECT    8    7   18   18    9                                       
CONECT    9    8   10   10   39                                       
CONECT   10    9    9   11   40                                       
CONECT   11   17   17   10   26                                       
CONECT   12   26   13   41   42                                       
CONECT   13   12   14   43   44                                       
CONECT   14   13   15   45   46                                       
CONECT   15   16   14   47   48                                       
CONECT   16   26   15   49   50                                       
CONECT   17   18   11   11   51                                       
CONECT   18    8    8   17   52                                       
CONECT   19   24   24   20   27                                       
CONECT   20   21   21   19   53                                       
CONECT   21   22   20   20   54                                       
CONECT   22   29   23   23   21                                       
CONECT   23   22   22   24   55                                       
CONECT   24   23    3   19   19                                       
CONECT   25    5    6   56                                            
CONECT   26   11   12   16                                            
CONECT   27   19    4   57                                            
CONECT   28    5    5                                                 
CONECT   29   22                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
