COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.293  -0.116  -0.157  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.271   1.358  -0.068  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.908   2.199  -0.908  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.738   3.538  -0.623  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.970   3.797   0.439  1.00  0.00           C  
HETATM    6  C   UNL     1       0.192  -0.808   0.537  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.096  -0.843  -0.114  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.127  -2.227  -0.191  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.336  -2.887  -0.311  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.523  -2.172  -0.355  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.507  -0.793  -0.278  1.00  0.00           C  
HETATM   12  C   UNL     1       2.499  -0.948   1.134  1.00  0.00           C  
HETATM   13  C   UNL     1       3.180  -1.790   0.051  1.00  0.00           C  
HETATM   14  C   UNL     1       3.841  -0.850  -0.969  1.00  0.00           C  
HETATM   15  C   UNL     1       2.807   0.235  -1.352  1.00  0.00           C  
HETATM   16  C   UNL     1       3.010   1.358  -0.313  1.00  0.00           C  
HETATM   17  C   UNL     1       5.759   0.625  -1.204  1.00  0.00           C  
HETATM   18  C   UNL     1       5.713  -1.011   0.572  1.00  0.00           C  
HETATM   19  C   UNL     1       4.135   0.842   0.613  1.00  0.00           C  
HETATM   20  C   UNL     1       3.509   0.033   1.737  1.00  0.00           C  
HETATM   21  F   UNL     1      -5.698  -2.827  -0.472  1.00  0.00           F  
HETATM   22  N   UNL     1      -0.873  -0.174   0.007  1.00  0.00           N  
HETATM   23  N   UNL     1       4.907  -0.101  -0.252  1.00  0.00           N1+
HETATM   24  O   UNL     1       0.065  -1.921   1.007  1.00  0.00           O  
HETATM   25  O   UNL     1       1.397  -0.206   0.547  1.00  0.00           O  
HETATM   26  O   UNL     1       3.295   1.531  -1.703  1.00  0.00           O  
HETATM   27  S   UNL     1      -2.414   2.290   1.153  1.00  0.00           S  
HETATM   28  H   UNL     1      -4.504   1.851  -1.739  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.192   4.319  -1.214  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.730   4.784   0.806  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.206  -2.789  -0.159  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.355  -3.965  -0.372  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.434  -0.239  -0.308  1.00  0.00           H  
HETATM   34  H   UNL     1       2.118  -1.604   1.917  1.00  0.00           H  
HETATM   35  H   UNL     1       3.939  -2.426   0.507  1.00  0.00           H  
HETATM   36  H   UNL     1       2.437  -2.411  -0.450  1.00  0.00           H  
HETATM   37  H   UNL     1       4.216  -1.387  -1.840  1.00  0.00           H  
HETATM   38  H   UNL     1       1.829  -0.093  -1.704  1.00  0.00           H  
HETATM   39  H   UNL     1       2.178   1.894   0.143  1.00  0.00           H  
HETATM   40  H   UNL     1       6.193  -0.079  -1.914  1.00  0.00           H  
HETATM   41  H   UNL     1       5.158   1.360  -1.741  1.00  0.00           H  
HETATM   42  H   UNL     1       6.556   1.134  -0.663  1.00  0.00           H  
HETATM   43  H   UNL     1       6.504  -0.448   1.068  1.00  0.00           H  
HETATM   44  H   UNL     1       5.077  -1.481   1.322  1.00  0.00           H  
HETATM   45  H   UNL     1       6.156  -1.779  -0.062  1.00  0.00           H  
HETATM   46  H   UNL     1       4.754   1.657   0.989  1.00  0.00           H  
HETATM   47  H   UNL     1       2.998   0.704   2.427  1.00  0.00           H  
HETATM   48  H   UNL     1       4.283  -0.521   2.268  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.792   0.746  -0.290  1.00  0.00           H  
CONECT    1    2    7    7   11                                       
CONECT    2   27    3    3    1                                       
CONECT    3    4    2    2   28                                       
CONECT    4    5    5    3   29                                       
CONECT    5    4    4   27   30                                       
CONECT    6   24   24   25   22                                       
CONECT    7   22    1    1    8                                       
CONECT    8    7    9    9   31                                       
CONECT    9    8    8   10   32                                       
CONECT   10   11   11    9   21                                       
CONECT   11    1   10   10   33                                       
CONECT   12   13   20   25   34                                       
CONECT   13   14   12   35   36                                       
CONECT   14   23   13   15   37                                       
CONECT   15   14   26   16   38                                       
CONECT   16   15   19   26   39                                       
CONECT   17   23   40   41   42                                       
CONECT   18   23   43   44   45                                       
CONECT   19   23   20   16   46                                       
CONECT   20   19   12   47   48                                       
CONECT   21   10                                                      
CONECT   22    6    7   49                                            
CONECT   23   18   17   14   19                                       
CONECT   24    6    6                                                 
CONECT   25   12    6                                                 
CONECT   26   15   16                                                 
CONECT   27    5    2                                                 
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
