COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.463   2.007  -0.577  1.00  0.00           C  
HETATM    2  C   UNL     1       5.937   1.590  -0.624  1.00  0.00           C  
HETATM    3  C   UNL     1       6.317   0.947   0.714  1.00  0.00           C  
HETATM    4  O   UNL     1       7.669   0.490   0.656  1.00  0.00           O  
HETATM    5  C   UNL     1       5.721  -0.848   2.347  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.486  -0.036   0.352  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.653  -1.135   0.648  1.00  0.00           N  
HETATM    8  C   UNL     1      -5.812   0.555   0.136  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.072   0.267   0.656  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.152   1.064   0.324  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.732   2.435  -1.041  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.647   1.645  -0.716  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.979  -2.200  -0.787  1.00  0.00           C  
HETATM   14  C   UNL     1       0.527  -2.378  -0.994  1.00  0.00           C  
HETATM   15  C   UNL     1       0.776  -3.150  -2.292  1.00  0.00           C  
HETATM   16  C   UNL     1       1.001  -0.298   0.100  1.00  0.00           C  
HETATM   17  C   UNL     1       3.603   0.783  -0.255  1.00  0.00           C  
HETATM   18  C   UNL     1       5.386  -0.237   0.984  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.217  -1.375   0.482  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.360  -0.139   0.068  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.648  -0.293   0.494  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.981   2.146  -0.524  1.00  0.00           C  
HETATM   23  F   UNL     1      -9.375   0.787   0.827  1.00  0.00           F  
HETATM   24  N   UNL     1      -4.649  -1.368   1.303  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.455  -1.841   1.366  1.00  0.00           N  
HETATM   26  O   UNL     1      -1.539  -1.519  -1.911  1.00  0.00           O  
HETATM   27  O   UNL     1       2.173  -3.418  -2.427  1.00  0.00           O  
HETATM   28  O   UNL     1       1.151  -1.095  -1.076  1.00  0.00           O  
HETATM   29  O   UNL     1       4.078   2.542  -1.844  1.00  0.00           O  
HETATM   30  O   UNL     1       6.752   2.741  -0.850  1.00  0.00           O  
HETATM   31  O   UNL     1       4.931  -2.021   2.550  1.00  0.00           O  
HETATM   32  O   UNL     1       4.029   0.215   0.985  1.00  0.00           O  
HETATM   33  O   UNL     1      -0.641   0.714   1.558  1.00  0.00           O  
HETATM   34  S   UNL     1       1.864   1.282  -0.126  1.00  0.00           S  
HETATM   35  H   UNL     1       4.324   2.764   0.196  1.00  0.00           H  
HETATM   36  H   UNL     1       6.087   0.873  -1.431  1.00  0.00           H  
HETATM   37  H   UNL     1       6.214   1.682   1.513  1.00  0.00           H  
HETATM   38  H   UNL     1       8.314   1.190   0.483  1.00  0.00           H  
HETATM   39  H   UNL     1       6.778  -1.112   2.377  1.00  0.00           H  
HETATM   40  H   UNL     1       5.505  -0.124   3.132  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.903   0.527  -0.483  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.205  -0.577   1.317  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.604   3.280  -1.702  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.672   1.872  -1.121  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.450  -3.177  -0.681  1.00  0.00           H  
HETATM   46  H   UNL     1       0.947  -2.933  -0.155  1.00  0.00           H  
HETATM   47  H   UNL     1       0.226  -4.091  -2.266  1.00  0.00           H  
HETATM   48  H   UNL     1       0.436  -2.555  -3.139  1.00  0.00           H  
HETATM   49  H   UNL     1       1.427  -0.825   0.953  1.00  0.00           H  
HETATM   50  H   UNL     1       3.711   0.044  -1.049  1.00  0.00           H  
HETATM   51  H   UNL     1       5.518  -0.989   0.207  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.836  -1.916   1.348  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.982   0.623  -0.597  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.827   2.767  -0.782  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.422  -1.984  -2.751  1.00  0.00           H  
HETATM   56  H   UNL     1       2.404  -3.905  -3.229  1.00  0.00           H  
HETATM   57  H   UNL     1       3.154   2.826  -1.887  1.00  0.00           H  
HETATM   58  H   UNL     1       6.561   3.203  -1.678  1.00  0.00           H  
HETATM   59  H   UNL     1       5.092  -2.462   3.396  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.200   1.574   1.546  1.00  0.00           H  
CONECT    1   17    2   29   35                                       
CONECT    2    3    1   30   36                                       
CONECT    3   18    4    2   37                                       
CONECT    4    3   38                                                 
CONECT    5   31   18   39   40                                       
CONECT    6   33   19   16   41                                       
CONECT    7   25   19   20                                            
CONECT    8   21   12   12    9                                       
CONECT    9    8   10   10   42                                       
CONECT   10    9    9   22   23                                       
CONECT   11   12   22   22   43                                       
CONECT   12    8    8   11   44                                       
CONECT   13   19   14   26   45                                       
CONECT   14   13   28   15   46                                       
CONECT   15   14   27   47   48                                       
CONECT   16    6   34   28   49                                       
CONECT   17   32   34    1   50                                       
CONECT   18    5   32    3   51                                       
CONECT   19    7    6   13   52                                       
CONECT   20    7   21   21   53                                       
CONECT   21   24   20   20    8                                       
CONECT   22   11   11   10   54                                       
CONECT   23   10                                                      
CONECT   24   25   25   21                                            
CONECT   25   24   24    7                                            
CONECT   26   13   55                                                 
CONECT   27   15   56                                                 
CONECT   28   16   14                                                 
CONECT   29    1   57                                                 
CONECT   30    2   58                                                 
CONECT   31    5   59                                                 
CONECT   32   18   17                                                 
CONECT   33    6   60                                                 
CONECT   34   16   17                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    9                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   22                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   31                                                      
CONECT   60   33                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
