COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.188   0.697   0.594  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.080  -0.734  -0.866  1.00  0.00           C  
HETATM    3  C   UNL     1       0.054   0.027  -0.618  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.808   0.607   1.549  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.940  -0.146   1.302  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.082  -0.813   0.092  1.00  0.00           C  
HETATM    7  C   UNL     1       2.653  -1.658  -0.039  1.00  0.00           C  
HETATM    8  C   UNL     1       5.333  -0.718   0.689  1.00  0.00           C  
HETATM    9  C   UNL     1       6.915   1.023   0.553  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.996   0.519  -0.087  1.00  0.00           C  
HETATM   11  C   UNL     1       2.805   1.791  -1.615  1.00  0.00           C  
HETATM   12  C   UNL     1       4.055   2.220  -1.271  1.00  0.00           C  
HETATM   13  C   UNL     1       4.890   1.396  -0.512  1.00  0.00           C  
HETATM   14  C   UNL     1       2.345   0.535  -1.219  1.00  0.00           C  
HETATM   15  C   UNL     1       4.428   0.123  -0.108  1.00  0.00           C  
HETATM   16  C   UNL     1       3.151  -0.302  -0.467  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.320   1.028   0.486  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.593   2.440  -0.039  1.00  0.00           C  
HETATM   19  C   UNL     1       7.495  -1.010   1.777  1.00  0.00           C  
HETATM   20  F   UNL     1       1.294   1.434   0.839  1.00  0.00           F  
HETATM   21  F   UNL     1      -7.804   2.905   0.485  1.00  0.00           F  
HETATM   22  N   UNL     1       1.061   0.119  -1.584  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.227  -1.579  -0.155  1.00  0.00           N  
HETATM   24  N   UNL     1       6.138   1.788  -0.152  1.00  0.00           N  
HETATM   25  N   UNL     1       6.554  -0.214   0.985  1.00  0.00           N  
HETATM   26  O   UNL     1      -4.399  -1.124   1.929  1.00  0.00           O  
HETATM   27  O   UNL     1      -5.605  -2.078  -0.009  1.00  0.00           O  
HETATM   28  O   UNL     1       4.995  -1.823   1.073  1.00  0.00           O  
HETATM   29  S   UNL     1      -4.672  -1.154   0.535  1.00  0.00           S  
HETATM   30 CL   UNL     1      -1.255  -1.567  -2.378  1.00  0.00          Cl  
HETATM   31  H   UNL     1      -0.700   1.124   2.491  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.716  -0.215   2.050  1.00  0.00           H  
HETATM   33  H   UNL     1       3.000  -2.412  -0.746  1.00  0.00           H  
HETATM   34  H   UNL     1       3.035  -1.889   0.955  1.00  0.00           H  
HETATM   35  H   UNL     1       1.563  -1.654  -0.018  1.00  0.00           H  
HETATM   36  H   UNL     1       7.898   1.389   0.810  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.055   0.497  -1.175  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.188   1.183   0.219  1.00  0.00           H  
HETATM   39  H   UNL     1       2.164   2.433  -2.202  1.00  0.00           H  
HETATM   40  H   UNL     1       4.398   3.195  -1.586  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.128   0.364   0.180  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.260   1.051   1.574  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.785   3.104   0.268  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.652   2.417  -1.127  1.00  0.00           H  
HETATM   45  H   UNL     1       8.107  -1.618   1.111  1.00  0.00           H  
HETATM   46  H   UNL     1       8.138  -0.344   2.354  1.00  0.00           H  
HETATM   47  H   UNL     1       6.942  -1.658   2.456  1.00  0.00           H  
HETATM   48  H   UNL     1       0.869  -0.106  -2.508  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.175  -2.358  -0.730  1.00  0.00           H  
CONECT    1    3    3    4   20                                       
CONECT    2   30    6    6    3                                       
CONECT    3    2   22    1    1                                       
CONECT    4    5    5    1   31                                       
CONECT    5    6    4    4   32                                       
CONECT    6   23    2    2    5                                       
CONECT    7   16   33   34   35                                       
CONECT    8   28   28   15   25                                       
CONECT    9   25   24   24   36                                       
CONECT   10   29   17   37   38                                       
CONECT   11   14   12   12   39                                       
CONECT   12   11   11   13   40                                       
CONECT   13   15   15   12   24                                       
CONECT   14   22   16   16   11                                       
CONECT   15   16    8   13   13                                       
CONECT   16    7   14   14   15                                       
CONECT   17   18   10   41   42                                       
CONECT   18   17   21   43   44                                       
CONECT   19   25   45   46   47                                       
CONECT   20    1                                                      
CONECT   21   18                                                      
CONECT   22    3   14   48                                            
CONECT   23   29    6   49                                            
CONECT   24   13    9    9                                            
CONECT   25    8   19    9                                            
CONECT   26   29   29                                                 
CONECT   27   29   29                                                 
CONECT   28    8    8                                                 
CONECT   29   26   26   23   27                                       
CONECT   29   27   10                                                 
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
