COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.677   0.384   0.098  1.00  0.00           C  
HETATM    2  C   UNL     1       6.295   0.023  -0.253  1.00  0.00           C  
HETATM    3  C   UNL     1       5.207   0.270   0.508  1.00  0.00           C  
HETATM    4  C   UNL     1       4.022  -0.174  -0.059  1.00  0.00           C  
HETATM    5  C   UNL     1       4.165  -0.768  -1.260  1.00  0.00           C  
HETATM    6  C   UNL     1       2.704  -0.008   0.603  1.00  0.00           C  
HETATM    7  C   UNL     1       2.620   0.621   1.843  1.00  0.00           C  
HETATM    8  C   UNL     1       1.393   0.775   2.458  1.00  0.00           C  
HETATM    9  C   UNL     1       0.245   0.308   1.846  1.00  0.00           C  
HETATM   10  C   UNL     1       0.320  -0.321   0.609  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.883  -1.210   0.744  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.109  -1.784   0.082  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.275  -1.783   1.075  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.493  -2.439   0.420  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.102  -3.825  -0.956  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.828  -3.224  -0.357  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.562   0.348  -0.869  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.876   1.177  -1.936  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.993   2.539  -1.740  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.798   3.077  -0.480  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.484   2.252   0.585  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.366   0.889   0.394  1.00  0.00           C  
HETATM   23  C   UNL     1       1.548  -0.475  -0.017  1.00  0.00           C  
HETATM   24  N   UNL     1       8.710   0.084  -0.766  1.00  0.00           N  
HETATM   25  N   UNL     1       7.926   0.993   1.227  1.00  0.00           N  
HETATM   26  N   UNL     1      -0.844  -0.794  -0.007  1.00  0.00           N  
HETATM   27  O   UNL     1      -1.831  -1.122   1.952  1.00  0.00           O  
HETATM   28  O   UNL     1      -5.155  -3.765   0.008  1.00  0.00           O  
HETATM   29  O   UNL     1      -3.451  -0.993  -1.058  1.00  0.00           O  
HETATM   30  S   UNL     1       5.804  -0.789  -1.733  1.00  0.00           S  
HETATM   31 CL   UNL     1      -3.946   4.790  -0.237  1.00  0.00          Cl  
HETATM   32  H   UNL     1       5.256   0.766   1.466  1.00  0.00           H  
HETATM   33  H   UNL     1       3.352  -1.174  -1.845  1.00  0.00           H  
HETATM   34  H   UNL     1       3.514   0.988   2.325  1.00  0.00           H  
HETATM   35  H   UNL     1       1.329   1.263   3.420  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.712   0.431   2.331  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.995  -2.343   1.967  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.518  -0.756   1.350  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.314  -2.480   1.137  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.798  -1.855  -0.449  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.388  -3.259  -1.843  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.919  -4.864  -1.231  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.035  -3.229  -1.105  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.518  -3.814   0.506  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.028   0.757  -2.919  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.237   3.185  -2.571  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.332   2.674   1.568  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.122   0.246   1.225  1.00  0.00           H  
HETATM   49  H   UNL     1       1.608  -0.959  -0.980  1.00  0.00           H  
HETATM   50  H   UNL     1       8.525  -0.365  -1.606  1.00  0.00           H  
HETATM   51  H   UNL     1       7.200   1.208   1.833  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.903  -0.823  -0.975  1.00  0.00           H  
HETATM   53  H   UNL     1       9.621   0.322  -0.534  1.00  0.00           H  
CONECT    1   24    2   25   25                                       
CONECT    2   30    1    3    3                                       
CONECT    3    2    2    4   32                                       
CONECT    4    5    5    3    6                                       
CONECT    5   30    4    4   33                                       
CONECT    6    4    7    7   23                                       
CONECT    7    6    6    8   34                                       
CONECT    8    7    9    9   35                                       
CONECT    9    8    8   10   36                                       
CONECT   10   23   23    9   26                                       
CONECT   11   26   27   27   12                                       
CONECT   12   11   16   13   29                                       
CONECT   13   12   14   37   38                                       
CONECT   14   13   28   39   40                                       
CONECT   15   16   28   41   42                                       
CONECT   16   12   15   43   44                                       
CONECT   17   29   18   18   22                                       
CONECT   18   17   17   19   45                                       
CONECT   19   18   20   20   46                                       
CONECT   20   19   19   21   31                                       
CONECT   21   22   22   20   47                                       
CONECT   22   17   21   21   48                                       
CONECT   23    6   10   10   49                                       
CONECT   24    1   50   53                                            
CONECT   25    1    1   51                                            
CONECT   26   10   11   52                                            
CONECT   27   11   11                                                 
CONECT   28   15   14                                                 
CONECT   29   12   17                                                 
CONECT   30    5    2                                                 
CONECT   31   20                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   24                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
