COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.512   0.982  -0.501  1.00  0.00           C  
HETATM    2  C   UNL     1       5.064   3.018   1.089  1.00  0.00           C  
HETATM    3  C   UNL     1       3.990   2.438   1.736  1.00  0.00           C  
HETATM    4  C   UNL     1       2.728   2.483   1.168  1.00  0.00           C  
HETATM    5  C   UNL     1       1.408   1.933   1.666  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.963  -0.759  -0.245  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.680  -2.239  -0.244  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.189  -2.045  -0.458  1.00  0.00           C  
HETATM    9  C   UNL     1       0.177  -2.370   0.090  1.00  0.00           C  
HETATM   10  C   UNL     1       2.950  -2.123  -0.196  1.00  0.00           C  
HETATM   11  C   UNL     1       2.916  -2.883   0.966  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.420   1.924  -0.222  1.00  0.00           C  
HETATM   13  C   UNL     1       4.096  -3.260   1.578  1.00  0.00           C  
HETATM   14  C   UNL     1       5.310  -2.881   1.035  1.00  0.00           C  
HETATM   15  C   UNL     1       5.349  -2.124  -0.122  1.00  0.00           C  
HETATM   16  C   UNL     1       4.172  -1.744  -0.739  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.309  -3.284   1.417  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.669  -4.026   1.390  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.599  -2.949   0.772  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.162   1.397   0.026  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.021   2.295   0.315  1.00  0.00           C  
HETATM   22  C   UNL     1       0.329   2.666   0.841  1.00  0.00           C  
HETATM   23  C   UNL     1       1.087   3.022  -0.455  1.00  0.00           C  
HETATM   24  C   UNL     1       2.543   3.109  -0.051  1.00  0.00           C  
HETATM   25  C   UNL     1       3.621   3.688  -0.698  1.00  0.00           C  
HETATM   26  C   UNL     1       4.879   3.648  -0.127  1.00  0.00           C  
HETATM   27  N   UNL     1      -0.801   1.777   0.555  1.00  0.00           N  
HETATM   28  N   UNL     1      -2.987   0.064   0.004  1.00  0.00           N  
HETATM   29  N   UNL     1      -2.293  -2.483   0.179  1.00  0.00           N  
HETATM   30  N   UNL     1      -5.227  -0.338  -0.493  1.00  0.00           N  
HETATM   31  O   UNL     1      -6.641   1.380  -0.728  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.635   3.263  -0.208  1.00  0.00           O  
HETATM   33  O   UNL     1      -2.185   3.499   0.334  1.00  0.00           O  
HETATM   34  O   UNL     1      -1.294  -1.390  -1.474  1.00  0.00           O  
HETATM   35  S   UNL     1       1.447  -1.646  -0.984  1.00  0.00           S  
HETATM   36 CL   UNL     1       4.221  -0.794  -2.192  1.00  0.00          Cl  
HETATM   37  H   UNL     1       6.047   2.981   1.535  1.00  0.00           H  
HETATM   38  H   UNL     1       4.135   1.949   2.688  1.00  0.00           H  
HETATM   39  H   UNL     1       1.355   0.859   1.489  1.00  0.00           H  
HETATM   40  H   UNL     1       1.285   2.149   2.727  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.843  -2.649  -1.241  1.00  0.00           H  
HETATM   42  H   UNL     1       0.272  -1.958   1.095  1.00  0.00           H  
HETATM   43  H   UNL     1       0.306  -3.452   0.127  1.00  0.00           H  
HETATM   44  H   UNL     1       1.969  -3.179   1.391  1.00  0.00           H  
HETATM   45  H   UNL     1       4.070  -3.851   2.481  1.00  0.00           H  
HETATM   46  H   UNL     1       6.231  -3.177   1.516  1.00  0.00           H  
HETATM   47  H   UNL     1       6.299  -1.829  -0.542  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.248  -2.634   2.290  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.487  -3.999   1.419  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.619  -4.910   0.756  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.990  -4.288   2.398  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.942  -2.251   1.536  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.445  -3.415   0.266  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.009   3.565   1.356  1.00  0.00           H  
HETATM   55  H   UNL     1       0.948   2.241  -1.202  1.00  0.00           H  
HETATM   56  H   UNL     1       0.743   3.981  -0.843  1.00  0.00           H  
HETATM   57  H   UNL     1       3.478   4.177  -1.650  1.00  0.00           H  
HETATM   58  H   UNL     1       5.717   4.102  -0.634  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.670   0.816   0.540  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.926  -0.986  -0.674  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.549   3.516  -0.395  1.00  0.00           H  
CONECT    1   12   30   31   31                                       
CONECT    2   26   26    3   37                                       
CONECT    3    2    4    4   38                                       
CONECT    4    3    3   24    5                                       
CONECT    5    4   22   39   40                                       
CONECT    6   28   28    7   30                                       
CONECT    7   29    6   19   41                                       
CONECT    8   34   34    9   29                                       
CONECT    9   35    8   42   43                                       
CONECT   10   35   16   16   11                                       
CONECT   11   10   13   13   44                                       
CONECT   12   20   20   32    1                                       
CONECT   13   11   11   14   45                                       
CONECT   14   15   15   13   46                                       
CONECT   15   16   14   14   47                                       
CONECT   16   36   10   10   15                                       
CONECT   17   29   18   48   49                                       
CONECT   18   17   19   50   51                                       
CONECT   19    7   18   52   53                                       
CONECT   20   21   28   12   12                                       
CONECT   21   27   33   33   20                                       
CONECT   22   23    5   27   54                                       
CONECT   23   24   22   55   56                                       
CONECT   24   25   25    4   23                                       
CONECT   25   26   24   24   57                                       
CONECT   26    2    2   25   58                                       
CONECT   27   22   21   59                                            
CONECT   28   20    6    6                                            
CONECT   29    8   17    7                                            
CONECT   30    6    1   60                                            
CONECT   31    1    1                                                 
CONECT   32   12   61                                                 
CONECT   33   21   21                                                 
CONECT   34    8    8                                                 
CONECT   35    9   10                                                 
CONECT   36   16                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   11                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   30                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
