COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.228  -0.026  -0.860  1.00  0.00           C  
HETATM    2  C   UNL     1       1.288   2.180  -0.335  1.00  0.00           C  
HETATM    3  C   UNL     1       0.066   2.716  -0.089  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.907   1.617  -0.180  1.00  0.00           C  
HETATM    5  C   UNL     1       9.102   0.460   0.353  1.00  0.00           C  
HETATM    6  C   UNL     1       8.492  -0.934   0.504  1.00  0.00           C  
HETATM    7  C   UNL     1       6.971  -0.815   0.621  1.00  0.00           C  
HETATM    8  C   UNL     1       3.944  -1.539  -0.122  1.00  0.00           C  
HETATM    9  C   UNL     1       2.894  -0.676   0.169  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.161   0.467  -0.484  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.824  -0.750  -0.634  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.195  -0.775  -0.476  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.875   0.405  -0.173  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.013   1.630   0.051  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.957  -0.907   0.088  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.801  -0.927   1.365  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.504  -2.282   1.486  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.569  -2.448  -1.036  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.866  -1.090  -1.130  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.578  -2.833   0.308  1.00  0.00           C  
HETATM   21  C   UNL     1      -9.278  -2.915   1.640  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.230   4.137   0.213  1.00  0.00           C  
HETATM   23  C   UNL     1       0.482   4.826   1.198  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.767   6.703   0.759  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.227   4.826  -0.484  1.00  0.00           C  
HETATM   26  C   UNL     1       2.614  -0.240  -2.180  1.00  0.00           C  
HETATM   27  C   UNL     1       3.658  -1.100  -2.465  1.00  0.00           C  
HETATM   28  C   UNL     1       4.323  -1.749  -1.440  1.00  0.00           C  
HETATM   29  F   UNL     1       2.523  -0.470   1.452  1.00  0.00           F  
HETATM   30  F   UNL     1       1.967   0.392  -3.183  1.00  0.00           F  
HETATM   31  N   UNL     1       4.618  -2.197   0.914  1.00  0.00           N  
HETATM   32  N   UNL     1       1.165   0.842  -0.572  1.00  0.00           N  
HETATM   33  N   UNL     1      -2.228   1.548  -0.036  1.00  0.00           N  
HETATM   34  N   UNL     1      -4.257   0.376  -0.014  1.00  0.00           N  
HETATM   35  N   UNL     1      -7.266  -2.532   0.255  1.00  0.00           N  
HETATM   36  N   UNL     1       0.185   6.092   1.436  1.00  0.00           N  
HETATM   37  N   UNL     1      -1.455   6.094  -0.186  1.00  0.00           N  
HETATM   38  O   UNL     1       6.395  -3.211  -0.402  1.00  0.00           O  
HETATM   39  O   UNL     1       6.597  -3.033   2.057  1.00  0.00           O  
HETATM   40  O   UNL     1      -9.196  -3.037  -0.715  1.00  0.00           O  
HETATM   41  S   UNL     1       6.247  -2.469   0.800  1.00  0.00           S  
HETATM   42  H   UNL     1       2.218   2.730  -0.347  1.00  0.00           H  
HETATM   43  H   UNL     1      10.186   0.376   0.270  1.00  0.00           H  
HETATM   44  H   UNL     1       8.705   0.935  -0.544  1.00  0.00           H  
HETATM   45  H   UNL     1       8.851   1.064   1.225  1.00  0.00           H  
HETATM   46  H   UNL     1       8.743  -1.538  -0.368  1.00  0.00           H  
HETATM   47  H   UNL     1       8.889  -1.409   1.402  1.00  0.00           H  
HETATM   48  H   UNL     1       6.719  -0.212   1.493  1.00  0.00           H  
HETATM   49  H   UNL     1       6.574  -0.341  -0.277  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.278  -1.652  -0.868  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.738  -1.703  -0.586  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.317   1.923  -0.954  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.897   1.489   0.672  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.386   2.410   0.483  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.228  -1.716   0.122  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.156  -0.772   2.230  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.761  -3.068   1.622  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.291  -2.542  -1.848  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.832  -3.247  -1.106  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.611  -0.295  -1.151  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.267  -1.053  -2.039  1.00  0.00           H  
HETATM   62  H   UNL     1      -9.208  -1.954   2.148  1.00  0.00           H  
HETATM   63  H   UNL     1     -10.327  -3.168   1.485  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.807  -3.685   2.252  1.00  0.00           H  
HETATM   65  H   UNL     1       1.263   4.331   1.757  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.983   7.738   0.979  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.801   4.332  -1.253  1.00  0.00           H  
HETATM   68  H   UNL     1       3.956  -1.265  -3.490  1.00  0.00           H  
HETATM   69  H   UNL     1       5.139  -2.420  -1.666  1.00  0.00           H  
HETATM   70  H   UNL     1       4.130  -2.493   1.699  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.546  -0.132   1.320  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.181  -2.268   2.340  1.00  0.00           H  
CONECT    1   26   32    9    9                                       
CONECT    2    3    3   32   42                                       
CONECT    3   22    2    2    4                                       
CONECT    4    3   10   10   33                                       
CONECT    5    6   43   44   45                                       
CONECT    6    5    7   46   47                                       
CONECT    7    6   41   48   49                                       
CONECT    8   28   28    9   31                                       
CONECT    9    1    1    8   29                                       
CONECT   10   32    4    4   11                                       
CONECT   11   10   12   12   50                                       
CONECT   12   11   11   13   51                                       
CONECT   13   33   33   12   34                                       
CONECT   14   34   52   53   54                                       
CONECT   15   19   34   16   55                                       
CONECT   16   15   17   56   71                                       
CONECT   17   35   16   57   72                                       
CONECT   18   19   35   58   59                                       
CONECT   19   18   15   60   61                                       
CONECT   20   40   40   35   21                                       
CONECT   21   20   62   63   64                                       
CONECT   22   25   25   23    3                                       
CONECT   23   36   36   22   65                                       
CONECT   24   37   37   36   66                                       
CONECT   25   37   22   22   67                                       
CONECT   26   30   27   27    1                                       
CONECT   27   26   26   28   68                                       
CONECT   28   27    8    8   69                                       
CONECT   29    9                                                      
CONECT   30   26                                                      
CONECT   31   41    8   70                                            
CONECT   32    2    1   10                                            
CONECT   33    4   13   13                                            
CONECT   34   13   15   14                                            
CONECT   35   18   20   17                                            
CONECT   36   24   23   23                                            
CONECT   37   24   24   25                                            
CONECT   38   41   41                                                 
CONECT   39   41   41                                                 
CONECT   40   20   20                                                 
CONECT   41    7   39   39   38                                       
CONECT   41   38   31                                                 
CONECT   42    2                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   18                                                      
CONECT   59   18                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   21                                                      
CONECT   63   21                                                      
CONECT   64   21                                                      
CONECT   65   23                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   31                                                      
CONECT   71   16                                                      
CONECT   72   17                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
