COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.954  -2.112   0.408  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.025  -1.252   0.550  1.00  0.00           C  
HETATM    3  C   UNL     1       0.259   1.372  -0.089  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.613   0.605  -0.013  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.682  -3.310   0.110  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.458  -4.144  -0.699  1.00  0.00           C  
HETATM    7  C   UNL     1       1.606   3.309   0.397  1.00  0.00           C  
HETATM    8  C   UNL     1       1.521   1.949   0.107  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.539  -0.252  -0.155  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.707  -1.614   0.054  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.858   2.184   0.015  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.856   0.107   0.340  1.00  0.00           C  
HETATM   13  C   UNL     1       2.745   1.126   0.008  1.00  0.00           C  
HETATM   14  C   UNL     1       3.859   1.437  -0.689  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.690   3.539   0.309  1.00  0.00           C  
HETATM   16  C   UNL     1       4.576  -0.518   0.096  1.00  0.00           C  
HETATM   17  C   UNL     1       3.999   2.711  -1.482  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.995   0.159  -2.052  1.00  0.00           C  
HETATM   19  C   UNL     1       5.886  -2.279  -1.059  1.00  0.00           C  
HETATM   20  C   UNL     1       6.822  -1.129   0.952  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.187   0.291  -0.540  1.00  0.00           C  
HETATM   22  C   UNL     1       5.544  -1.656   0.296  1.00  0.00           C  
HETATM   23  N   UNL     1       0.518   4.049   0.487  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.464  -2.309   0.448  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.639  -3.573  -0.778  1.00  0.00           N  
HETATM   26  N   UNL     1       4.812   0.533  -0.615  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.618  -2.486  -0.090  1.00  0.00           N  
HETATM   28  N   UNL     1      -1.807   4.363   0.414  1.00  0.00           N  
HETATM   29  O   UNL     1       4.949  -2.645   1.139  1.00  0.00           O  
HETATM   30  O   UNL     1      -2.103   1.668  -0.167  1.00  0.00           O  
HETATM   31  F   UNL     1      -6.905   0.947   0.479  1.00  0.00           F  
HETATM   32  S   UNL     1       3.014  -0.433   0.785  1.00  0.00           S  
HETATM   33  H   UNL     1      -5.085  -3.171   0.576  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.995  -1.638   0.825  1.00  0.00           H  
HETATM   35  H   UNL     1       0.160   0.322  -0.319  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.483   1.665  -0.176  1.00  0.00           H  
HETATM   37  H   UNL     1       0.347  -3.459   0.402  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.150  -5.069  -1.165  1.00  0.00           H  
HETATM   39  H   UNL     1       2.574   3.763   0.550  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.410  -0.273  -0.024  1.00  0.00           H  
HETATM   41  H   UNL     1       4.492   3.467  -0.872  1.00  0.00           H  
HETATM   42  H   UNL     1       4.594   2.519  -2.375  1.00  0.00           H  
HETATM   43  H   UNL     1       3.011   3.067  -1.774  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.695   3.996   0.284  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.697   5.305   0.618  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.773   0.722  -2.567  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.017   0.551  -2.330  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.059  -0.892  -2.336  1.00  0.00           H  
HETATM   49  H   UNL     1       6.340  -1.525  -1.701  1.00  0.00           H  
HETATM   50  H   UNL     1       6.586  -3.102  -0.914  1.00  0.00           H  
HETATM   51  H   UNL     1       4.975  -2.654  -1.526  1.00  0.00           H  
HETATM   52  H   UNL     1       6.578  -0.685   1.918  1.00  0.00           H  
HETATM   53  H   UNL     1       7.522  -1.952   1.097  1.00  0.00           H  
HETATM   54  H   UNL     1       7.276  -0.375   0.310  1.00  0.00           H  
HETATM   55  H   UNL     1       5.516  -3.408   1.311  1.00  0.00           H  
CONECT    1    2   10   10   33                                       
CONECT    2    1   12   12   34                                       
CONECT    3    8   11   11   35                                       
CONECT    4    9    9   12   36                                       
CONECT    5    6   24   24   37                                       
CONECT    6    5   25   25   38                                       
CONECT    7    8    8   23   39                                       
CONECT    8    3    7    7   13                                       
CONECT    9    4    4   10   21                                       
CONECT   10    1    1    9   27                                       
CONECT   11    3    3   15   30                                       
CONECT   12    2    2    4   31                                       
CONECT   13    8   14   14   32                                       
CONECT   14   13   13   17   26                                       
CONECT   15   11   23   23   28                                       
CONECT   16   22   26   26   32                                       
CONECT   17   14   41   42   43                                       
CONECT   18   21   46   47   48                                       
CONECT   19   22   49   50   51                                       
CONECT   20   22   52   53   54                                       
CONECT   21    9   18   30   40                                       
CONECT   22   16   19   20   29                                       
CONECT   23    7   15   15                                            
CONECT   24    5    5   27                                            
CONECT   25    6    6   27                                            
CONECT   26   14   16   16                                            
CONECT   27   10   24   25                                            
CONECT   28   15   44   45                                            
CONECT   29   22   55                                                 
CONECT   30   11   21                                                 
CONECT   31   12                                                      
CONECT   32   13   16                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40   21                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   28                                                      
CONECT   45   28                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   29                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
