COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.005  -2.842  -0.296  1.00  0.00           C  
HETATM    2  C   UNL     1       4.329   1.883  -0.949  1.00  0.00           C  
HETATM    3  C   UNL     1       6.033   4.054  -0.382  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.772   1.576  -0.105  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.740   0.585  -1.840  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.067   0.769  -1.289  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.348  -1.573  -0.780  1.00  0.00           C  
HETATM    8  C   UNL     1       0.374  -0.557  -1.278  1.00  0.00           C  
HETATM    9  N   UNL     1       1.709  -0.845  -1.187  1.00  0.00           N  
HETATM   10  C   UNL     1       1.883  -2.085  -0.613  1.00  0.00           C  
HETATM   11  C   UNL     1       0.602  -2.595  -0.334  1.00  0.00           C  
HETATM   12  C   UNL     1       0.466  -3.852   0.258  1.00  0.00           C  
HETATM   13  C   UNL     1       1.591  -4.586   0.564  1.00  0.00           C  
HETATM   14 CL   UNL     1       1.428  -6.150   1.300  1.00  0.00          Cl  
HETATM   15  C   UNL     1       2.855  -4.081   0.288  1.00  0.00           C  
HETATM   16  C   UNL     1       2.792   0.036  -1.633  1.00  0.00           C  
HETATM   17  C   UNL     1       3.260   0.902  -0.462  1.00  0.00           C  
HETATM   18  S   UNL     1       4.832   2.958   0.423  1.00  0.00           S  
HETATM   19  O   UNL     1       3.711   3.733   0.825  1.00  0.00           O  
HETATM   20  O   UNL     1       5.514   2.171   1.389  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.200   0.712  -1.853  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.524   0.955  -1.275  1.00  0.00           N  
HETATM   23  O   UNL     1      -0.925   2.026   0.643  1.00  0.00           O  
HETATM   24  N   UNL     1      -3.102   1.627   0.108  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.740   1.013  -0.959  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.106  -0.067  -3.005  1.00  0.00           C  
HETATM   27  N   UNL     1      -4.379  -0.282  -3.278  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.347   0.110  -2.470  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.760   2.227   1.271  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.918   1.171   2.367  1.00  0.00           C  
HETATM   31  F   UNL     1      -2.657   0.701   2.747  1.00  0.00           F  
HETATM   32  F   UNL     1      -4.557   1.741   3.474  1.00  0.00           F  
HETATM   33  F   UNL     1      -4.687   0.107   1.883  1.00  0.00           F  
HETATM   34  H   UNL     1       3.992  -2.462  -0.510  1.00  0.00           H  
HETATM   35  H   UNL     1       5.194   1.327  -1.311  1.00  0.00           H  
HETATM   36  H   UNL     1       3.923   2.490  -1.757  1.00  0.00           H  
HETATM   37  H   UNL     1       6.421   4.766   0.347  1.00  0.00           H  
HETATM   38  H   UNL     1       6.854   3.461  -0.784  1.00  0.00           H  
HETATM   39  H   UNL     1       5.545   4.595  -1.193  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.864   1.087  -0.635  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.425  -1.627  -0.720  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.515  -4.247   0.475  1.00  0.00           H  
HETATM   43  H   UNL     1       3.729  -4.668   0.528  1.00  0.00           H  
HETATM   44  H   UNL     1       3.625  -0.568  -1.995  1.00  0.00           H  
HETATM   45  H   UNL     1       2.431   0.677  -2.438  1.00  0.00           H  
HETATM   46  H   UNL     1       3.679   0.264   0.316  1.00  0.00           H  
HETATM   47  H   UNL     1       2.413   1.458  -0.060  1.00  0.00           H  
HETATM   48  H   UNL     1       0.458   1.548  -1.617  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.288   0.613  -2.935  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.345  -0.400  -3.695  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.375  -0.086  -2.738  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.155   3.052   1.646  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.743   2.599   0.980  1.00  0.00           H  
CONECT    1   10   10   15   34                                       
CONECT    2   18   17   35   36                                       
CONECT    3   18   37   38   39                                       
CONECT    4   24   23   23   22                                       
CONECT    5   25   25   26   22                                       
CONECT    6   28   28   25   40                                       
CONECT    7    8    8   11   41                                       
CONECT    8   21    9    7    7                                       
CONECT    9   16    8   10                                            
CONECT   10    9    1    1   11                                       
CONECT   11   10    7   12   12                                       
CONECT   12   11   11   13   42                                       
CONECT   13   15   15   12   14                                       
CONECT   14   13                                                      
CONECT   15    1   13   13   43                                       
CONECT   16   17    9   44   45                                       
CONECT   17    2   16   46   47                                       
CONECT   18   20   20    3   19                                       
CONECT   18   19    2                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21   22    8   48   49                                       
CONECT   22    4    5   21                                            
CONECT   23    4    4                                                 
CONECT   24   29   25    4                                            
CONECT   25    6   24    5    5                                       
CONECT   26   27   27    5   50                                       
CONECT   27   28   26   26                                            
CONECT   28    6    6   27   51                                       
CONECT   29   30   24   52   53                                       
CONECT   30   32   33   29   31                                       
CONECT   31   30                                                      
CONECT   32   30                                                      
CONECT   33   30                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42   12                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
