COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.349   0.166  -1.666  1.00  0.00           C  
HETATM    2  C   UNL     1       2.960  -0.525  -0.385  1.00  0.00           C  
HETATM    3  C   UNL     1       2.163   0.213   0.658  1.00  0.00           C  
HETATM    4  C   UNL     1       3.107   0.749   1.736  1.00  0.00           C  
HETATM    5  C   UNL     1       3.705  -0.420   2.519  1.00  0.00           C  
HETATM    6  C   UNL     1       4.232   1.549   1.076  1.00  0.00           C  
HETATM    7  C   UNL     1       0.023  -0.223   1.738  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.974  -1.162   2.366  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.184  -0.219   1.939  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.308   0.514   2.382  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.310   1.011   3.668  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.219   0.107   4.059  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.094  -0.101   4.977  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.057   0.028   6.356  1.00  0.00           C  
HETATM   15  C   UNL     1       0.140  -0.235   6.977  1.00  0.00           C  
HETATM   16  C   UNL     1       1.212  -0.591   6.225  1.00  0.00           C  
HETATM   17  C   UNL     1       2.107   0.631  -2.382  1.00  0.00           C  
HETATM   18  C   UNL     1       0.291   0.273  -3.966  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.196  -0.828  -4.909  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.820  -1.472  -6.492  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.975  -1.007  -7.379  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.176   1.146  -7.366  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.000   0.736  -6.478  1.00  0.00           C  
HETATM   24  N   UNL     1       1.193  -0.699   1.269  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.154  -0.406   2.793  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.267   0.797   4.466  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.400   0.733   1.529  1.00  0.00           N  
HETATM   28  N   UNL     1       1.497  -0.179  -3.270  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.406  -0.375  -5.608  1.00  0.00           N  
HETATM   30  O   UNL     1       3.287  -1.672  -0.195  1.00  0.00           O  
HETATM   31  O   UNL     1      -0.227   0.960   1.655  1.00  0.00           O  
HETATM   32  O   UNL     1      -3.144  -0.675   0.808  1.00  0.00           O  
HETATM   33  O   UNL     1       1.657   1.735  -2.161  1.00  0.00           O  
HETATM   34  O   UNL     1      -2.537   0.061  -8.219  1.00  0.00           O  
HETATM   35  F   UNL     1       4.159   1.268  -1.373  1.00  0.00           F  
HETATM   36  F   UNL     1       4.052  -0.725  -2.483  1.00  0.00           F  
HETATM   37  S   UNL     1       0.583  -0.581   4.609  1.00  0.00           S  
HETATM   38  H   UNL     1       1.635   1.044   0.191  1.00  0.00           H  
HETATM   39  H   UNL     1       2.552   1.396   2.416  1.00  0.00           H  
HETATM   40  H   UNL     1       4.377  -0.038   3.286  1.00  0.00           H  
HETATM   41  H   UNL     1       2.903  -0.990   2.989  1.00  0.00           H  
HETATM   42  H   UNL     1       4.260  -1.067   1.838  1.00  0.00           H  
HETATM   43  H   UNL     1       4.855   0.879   0.483  1.00  0.00           H  
HETATM   44  H   UNL     1       3.803   2.314   0.429  1.00  0.00           H  
HETATM   45  H   UNL     1       4.840   2.024   1.846  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.270  -1.917   1.638  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.522  -1.647   3.231  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.158   1.575   4.027  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.933   0.315   6.919  1.00  0.00           H  
HETATM   50  H   UNL     1       0.228  -0.154   8.050  1.00  0.00           H  
HETATM   51  H   UNL     1       2.214  -0.825   6.553  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.486   0.497  -3.236  1.00  0.00           H  
HETATM   53  H   UNL     1       0.518   1.169  -4.542  1.00  0.00           H  
HETATM   54  H   UNL     1       0.581  -1.053  -5.639  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.424  -1.725  -4.333  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.979  -1.771  -7.117  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.144  -2.321  -5.889  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.315  -1.837  -7.997  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.797  -0.661  -6.752  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.889   2.005  -7.973  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.026   1.414  -6.739  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.694   1.584  -5.865  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.165   0.421  -7.104  1.00  0.00           H  
HETATM   64  H   UNL     1       1.393  -1.646   1.335  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.166   1.238   1.843  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.388   0.379   0.626  1.00  0.00           H  
HETATM   67  H   UNL     1       1.858  -1.062  -3.447  1.00  0.00           H  
CONECT    1    2   17   35   36                                       
CONECT    2    1    3   30   30                                       
CONECT    3    2    4   24   38                                       
CONECT    4    3    5    6   39                                       
CONECT    5    4   40   41   42                                       
CONECT    6    4   43   44   45                                       
CONECT    7    8   24   31   31                                       
CONECT    8    7   25   46   47                                       
CONECT    9   10   25   32   32                                       
CONECT   10    9   11   11   27                                       
CONECT   11   10   10   26   48                                       
CONECT   12   13   25   26   26                                       
CONECT   13   12   14   14   37                                       
CONECT   14   13   13   15   49                                       
CONECT   15   14   16   16   50                                       
CONECT   16   15   15   37   51                                       
CONECT   17    1   28   33   33                                       
CONECT   18   19   28   52   53                                       
CONECT   19   18   29   54   55                                       
CONECT   20   21   29   56   57                                       
CONECT   21   20   34   58   59                                       
CONECT   22   23   34   60   61                                       
CONECT   23   22   29   62   63                                       
CONECT   24    3    7   64                                            
CONECT   25    8    9   12                                            
CONECT   26   11   12   12                                            
CONECT   27   10   65   66                                            
CONECT   28   17   18   67                                            
CONECT   29   19   20   23                                            
CONECT   30    2    2                                                 
CONECT   31    7    7                                                 
CONECT   32    9    9                                                 
CONECT   33   17   17                                                 
CONECT   34   21   22                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37   13   16                                                 
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48   11                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   27                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
