COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.254  -2.242   0.013  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.674  -1.974  -0.004  1.00  0.00           C  
HETATM    3  C   UNL     1       2.060  -2.130   0.006  1.00  0.00           C  
HETATM    4  C   UNL     1       5.671  -1.872   0.015  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.779  -2.796  -0.009  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.205  -0.336  -0.018  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.711   1.053  -0.025  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.815   2.126  -0.027  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.296   3.422  -0.033  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.658   3.658  -0.038  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.551   2.602  -0.035  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.086   1.300  -0.035  1.00  0.00           C  
HETATM   13  C   UNL     1       3.971   0.497   1.169  1.00  0.00           C  
HETATM   14  C   UNL     1       3.323   1.773   1.739  1.00  0.00           C  
HETATM   15  C   UNL     1       2.885   2.753   0.630  1.00  0.00           C  
HETATM   16  C   UNL     1       3.895   2.876  -0.479  1.00  0.00           C  
HETATM   17  C   UNL     1       3.201  -1.381   0.007  1.00  0.00           C  
HETATM   18  C   UNL     1       3.547   1.855  -1.586  1.00  0.00           C  
HETATM   19  C   UNL     1       3.953   0.504  -1.216  1.00  0.00           C  
HETATM   20  C   UNL     1       2.435  -3.480   0.002  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.302  -2.489   0.001  1.00  0.00           C  
HETATM   22  F   UNL     1      -5.959   0.269  -0.039  1.00  0.00           F  
HETATM   23  F   UNL     1      -1.484   1.897  -0.023  1.00  0.00           F  
HETATM   24  F   UNL     1       3.856   4.171  -1.007  1.00  0.00           F  
HETATM   25  N   UNL     1      -1.955  -0.670  -0.009  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.763  -4.176  -0.005  1.00  0.00           N  
HETATM   27  N   UNL     1       3.274   0.012   0.002  1.00  0.00           N  
HETATM   28  N   UNL     1       2.674   4.079   1.226  1.00  0.00           N  
HETATM   29  N   UNL     1       3.743  -3.546   0.010  1.00  0.00           N  
HETATM   30  N   UNL     1       0.739  -1.634   0.001  1.00  0.00           N  
HETATM   31  O   UNL     1      -0.103  -3.691   0.005  1.00  0.00           O  
HETATM   32  S   UNL     1      -4.216  -1.777  -0.022  1.00  0.00           S  
HETATM   33  H   UNL     1       6.020  -1.776   1.043  1.00  0.00           H  
HETATM   34  H   UNL     1       6.249  -2.643  -0.494  1.00  0.00           H  
HETATM   35  H   UNL     1       5.799  -0.921  -0.502  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.605   4.252  -0.035  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.028   4.673  -0.043  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.614   2.794  -0.038  1.00  0.00           H  
HETATM   39  H   UNL     1       5.005   0.715   0.900  1.00  0.00           H  
HETATM   40  H   UNL     1       3.960  -0.278   1.935  1.00  0.00           H  
HETATM   41  H   UNL     1       2.449   1.493   2.328  1.00  0.00           H  
HETATM   42  H   UNL     1       4.040   2.274   2.390  1.00  0.00           H  
HETATM   43  H   UNL     1       1.941   2.407   0.208  1.00  0.00           H  
HETATM   44  H   UNL     1       4.892   2.670  -0.090  1.00  0.00           H  
HETATM   45  H   UNL     1       2.471   1.869  -1.758  1.00  0.00           H  
HETATM   46  H   UNL     1       4.058   2.140  -2.505  1.00  0.00           H  
HETATM   47  H   UNL     1       3.723  -0.170  -2.041  1.00  0.00           H  
HETATM   48  H   UNL     1       5.029   0.494  -1.044  1.00  0.00           H  
HETATM   49  H   UNL     1       1.760  -4.323  -0.002  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.918  -4.652   0.002  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.598  -4.671  -0.010  1.00  0.00           H  
HETATM   52  H   UNL     1       2.386   4.748   0.528  1.00  0.00           H  
HETATM   53  H   UNL     1       2.007   4.034   1.981  1.00  0.00           H  
HETATM   54  H   UNL     1       0.581  -0.677  -0.002  1.00  0.00           H  
CONECT    1   29   17    4                                            
CONECT    2    5    5   21   25                                       
CONECT    3   20   30   17   17                                       
CONECT    4    1   33   34   35                                       
CONECT    5   26    2    2   32                                       
CONECT    6   32   25   25    7                                       
CONECT    7    6   12   12    8                                       
CONECT    8    7   23    9    9                                       
CONECT    9    8    8   10   36                                       
CONECT   10   11   11    9   37                                       
CONECT   11   12   10   10   38                                       
CONECT   12   22    7    7   11                                       
CONECT   13   27   14   39   40                                       
CONECT   14   13   15   41   42                                       
CONECT   15   14   16   28   43                                       
CONECT   16   18   15   24   44                                       
CONECT   17    3    3    1   27                                       
CONECT   18   19   16   45   46                                       
CONECT   19   27   18   47   48                                       
CONECT   20   29   29    3   49                                       
CONECT   21   31   31    2   30                                       
CONECT   22   12                                                      
CONECT   23    8                                                      
CONECT   24   16                                                      
CONECT   25    2    6    6                                            
CONECT   26    5   50   51                                            
CONECT   27   17   13   19                                            
CONECT   28   15   52   53                                            
CONECT   29   20   20    1                                            
CONECT   30   21    3   54                                            
CONECT   31   21   21                                                 
CONECT   32    5    6                                                 
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   30                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
