COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.634  -1.221   0.309  1.00  0.00           C  
HETATM    2  C   UNL     1       6.935   0.498  -2.264  1.00  0.00           C  
HETATM    3  C   UNL     1       4.218  -0.629   0.839  1.00  0.00           C  
HETATM    4  C   UNL     1       5.534  -0.339   1.143  1.00  0.00           C  
HETATM    5  C   UNL     1       6.013  -0.421   2.570  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.894  -3.227  -0.437  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.630  -4.302  -0.928  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.049  -5.547  -1.016  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.732  -5.743  -0.619  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.990  -4.705  -0.135  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.561  -3.430  -0.030  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.071  -2.180   0.420  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.685  -1.904   0.942  1.00  0.00           C  
HETATM   14  C   UNL     1       0.226  -1.502  -0.220  1.00  0.00           C  
HETATM   15  O   UNL     1       2.485  -0.845  -0.776  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.076  -1.274   0.297  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.188  -1.900  -0.234  1.00  0.00           N  
HETATM   18  C   UNL     1       6.413   0.026   0.139  1.00  0.00           C  
HETATM   19 CL   UNL     1       8.066   0.390   0.523  1.00  0.00          Cl  
HETATM   20  C   UNL     1       5.976   0.100  -1.172  1.00  0.00           C  
HETATM   21  C   UNL     1       4.660  -0.189  -1.480  1.00  0.00           C  
HETATM   22  C   UNL     1       3.779  -0.560  -0.475  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.989   0.150   0.655  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.952   0.602   1.101  1.00  0.00           O  
HETATM   25  N   UNL     1      -4.058   0.953   0.487  1.00  0.00           N  
HETATM   26  S   UNL     1      -3.960   2.557   0.889  1.00  0.00           S  
HETATM   27  O   UNL     1      -5.220   3.129   0.568  1.00  0.00           O  
HETATM   28  O   UNL     1      -3.391   2.610   2.191  1.00  0.00           O  
HETATM   29  C   UNL     1      -0.944   4.456  -1.902  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.280   4.414  -2.253  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.201   3.835  -1.401  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.786   3.296  -0.197  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.449   3.338   0.154  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.529   3.918  -0.698  1.00  0.00           C  
HETATM   35  H   UNL     1       1.594  -0.410   1.037  1.00  0.00           H  
HETATM   36  H   UNL     1       2.028  -2.118   0.786  1.00  0.00           H  
HETATM   37  H   UNL     1       6.916   1.581  -2.387  1.00  0.00           H  
HETATM   38  H   UNL     1       7.942   0.180  -1.997  1.00  0.00           H  
HETATM   39  H   UNL     1       6.639   0.021  -3.199  1.00  0.00           H  
HETATM   40  H   UNL     1       3.533  -0.914   1.624  1.00  0.00           H  
HETATM   41  H   UNL     1       6.378  -1.427   2.773  1.00  0.00           H  
HETATM   42  H   UNL     1       6.819   0.297   2.724  1.00  0.00           H  
HETATM   43  H   UNL     1       5.188  -0.190   3.244  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.655  -4.159  -1.238  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.622  -6.379  -1.396  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.291  -6.726  -0.695  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.967  -4.867   0.171  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.725  -1.093   1.669  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.290  -2.801   1.419  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.168  -0.604  -0.697  1.00  0.00           H  
HETATM   51  H   UNL     1       0.266  -2.312  -0.948  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.039  -1.474  -0.423  1.00  0.00           H  
HETATM   53  H   UNL     1       4.319  -0.130  -2.503  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.885   0.593   0.131  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.224   4.905  -2.570  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.605   4.835  -3.193  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.245   3.803  -1.675  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.125   2.917   1.094  1.00  0.00           H  
HETATM   59  H   UNL     1       0.516   3.946  -0.426  1.00  0.00           H  
CONECT    1   15   14   35   36                                       
CONECT    2   20   37   38   39                                       
CONECT    3   22   22    4   40                                       
CONECT    4   18   18    3    5                                       
CONECT    5    4   41   42   43                                       
CONECT    6    7    7   11   17                                       
CONECT    7    8    6    6   44                                       
CONECT    8    9    9    7   45                                       
CONECT    9    8    8   10   46                                       
CONECT   10    9   11   11   47                                       
CONECT   11   10   10    6   12                                       
CONECT   12   11   13   16   16                                       
CONECT   13   12   14   48   49                                       
CONECT   14   13    1   50   51                                       
CONECT   15   22    1                                                 
CONECT   16   12   12   17   23                                       
CONECT   17    6   16   52                                            
CONECT   18   20   19    4    4                                       
CONECT   19   18                                                      
CONECT   20    2   21   21   18                                       
CONECT   21   20   20   22   53                                       
CONECT   22   21   15    3    3                                       
CONECT   23   16   25   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   54                                            
CONECT   26   32   25   27   27                                       
CONECT   26   28   28                                                 
CONECT   27   26   26                                                 
CONECT   28   26   26                                                 
CONECT   29   30   34   34   55                                       
CONECT   30   31   31   29   56                                       
CONECT   31   30   30   32   57                                       
CONECT   32   31   26   33   33                                       
CONECT   33   32   32   34   58                                       
CONECT   34   29   29   33   59                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   17                                                      
CONECT   53   21                                                      
CONECT   54   25                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   33                                                      
CONECT   59   34                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
