COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.603   0.916  -0.691  1.00  0.00           C  
HETATM    2  C   UNL     1       3.584   0.085   0.143  1.00  0.00           C  
HETATM    3  C   UNL     1       2.161  -1.875   0.009  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.337  -0.410   0.071  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.586  -0.253   1.221  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.955   0.904   0.076  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.646   0.778  -1.114  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.864   0.113  -1.122  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.181   0.460  -0.232  1.00  0.00           C  
HETATM   10  C   UNL     1       0.198   1.068  -0.236  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.463  -0.174  -1.595  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.262  -0.613   0.856  1.00  0.00           C  
HETATM   13  C   UNL     1       1.122  -1.124  -0.831  1.00  0.00           C  
HETATM   14  C   UNL     1       4.539  -2.126   0.390  1.00  0.00           C  
HETATM   15  C   UNL     1       5.859  -1.404   0.298  1.00  0.00           C  
HETATM   16  C   UNL     1       6.235  -0.524   1.296  1.00  0.00           C  
HETATM   17  C   UNL     1       7.445   0.139   1.213  1.00  0.00           C  
HETATM   18  C   UNL     1       8.280  -0.079   0.131  1.00  0.00           C  
HETATM   19  C   UNL     1       7.903  -0.959  -0.867  1.00  0.00           C  
HETATM   20  C   UNL     1       6.695  -1.626  -0.780  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.652  -1.145   0.114  1.00  0.00           C  
HETATM   22  F   UNL     1      -7.595  -2.251  -0.740  1.00  0.00           F  
HETATM   23  F   UNL     1      -7.903  -1.577   1.420  1.00  0.00           F  
HETATM   24  F   UNL     1      -8.678  -0.289  -0.300  1.00  0.00           F  
HETATM   25  N   UNL     1      -4.435   0.389   1.192  1.00  0.00           N  
HETATM   26  N   UNL     1       1.265   0.317  -0.572  1.00  0.00           N  
HETATM   27  N   UNL     1       3.496  -1.324  -0.263  1.00  0.00           N  
HETATM   28  O   UNL     1       0.347   2.234   0.063  1.00  0.00           O  
HETATM   29  O   UNL     1      -2.490   2.657  -0.991  1.00  0.00           O  
HETATM   30  O   UNL     1      -2.291   2.222   1.436  1.00  0.00           O  
HETATM   31  S   UNL     1      -2.411   1.751   0.101  1.00  0.00           S  
HETATM   32 CL   UNL     1       9.800   0.754   0.026  1.00  0.00          Cl  
HETATM   33  H   UNL     1       2.580   1.939  -0.317  1.00  0.00           H  
HETATM   34  H   UNL     1       4.598   0.448  -0.020  1.00  0.00           H  
HETATM   35  H   UNL     1       1.928  -1.757   1.067  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.946  -0.661   2.154  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.249   1.201  -2.025  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.429   0.006  -2.036  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.296   0.563  -2.380  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.796  -1.023  -1.746  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.498  -0.515  -1.630  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.123  -1.255   0.671  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.352  -1.214   0.842  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.367  -0.136   1.830  1.00  0.00           H  
HETATM   45  H   UNL     1       1.292  -1.325  -1.889  1.00  0.00           H  
HETATM   46  H   UNL     1       4.619  -3.093  -0.108  1.00  0.00           H  
HETATM   47  H   UNL     1       4.280  -2.277   1.437  1.00  0.00           H  
HETATM   48  H   UNL     1       5.584  -0.354   2.140  1.00  0.00           H  
HETATM   49  H   UNL     1       7.740   0.826   1.992  1.00  0.00           H  
HETATM   50  H   UNL     1       8.554  -1.129  -1.712  1.00  0.00           H  
HETATM   51  H   UNL     1       6.400  -2.313  -1.559  1.00  0.00           H  
HETATM   52  H   UNL     1       2.913   0.914  -1.735  1.00  0.00           H  
HETATM   53  H   UNL     1       3.331   0.176   1.200  1.00  0.00           H  
HETATM   54  H   UNL     1       2.144  -2.933  -0.252  1.00  0.00           H  
HETATM   55  H   UNL     1       0.120  -1.449  -0.550  1.00  0.00           H  
CONECT    1    2   26   33   52                                       
CONECT    2   27    1   34   53                                       
CONECT    3   27   13   35   54                                       
CONECT    4    8    8    5   21                                       
CONECT    5   25   25    4   36                                       
CONECT    6   31    7    7   25                                       
CONECT    7    6    6    8   37                                       
CONECT    8    7    4    4   38                                       
CONECT    9   10   12   11   31                                       
CONECT   10   26   28   28    9                                       
CONECT   11    9   39   40   41                                       
CONECT   12    9   42   43   44                                       
CONECT   13    3   26   45   55                                       
CONECT   14   15   27   46   47                                       
CONECT   15   20   14   16   16                                       
CONECT   16   15   15   17   48                                       
CONECT   17   18   18   16   49                                       
CONECT   18   19   32   17   17                                       
CONECT   19   20   20   18   50                                       
CONECT   20   19   19   15   51                                       
CONECT   21    4   24   23   22                                       
CONECT   22   21                                                      
CONECT   23   21                                                      
CONECT   24   21                                                      
CONECT   25    6    5    5                                            
CONECT   26   13    1   10                                            
CONECT   27   14    3    2                                            
CONECT   28   10   10                                                 
CONECT   29   31   31                                                 
CONECT   30   31   31                                                 
CONECT   31    9   29   29   30                                       
CONECT   31   30    6                                                 
CONECT   32   18                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52    1                                                      
CONECT   53    2                                                      
CONECT   54    3                                                      
CONECT   55   13                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
