COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.534  -0.310  -0.955  1.00  0.00           C  
HETATM    2  C   UNL     1       2.947   0.925  -0.645  1.00  0.00           C  
HETATM    3  C   UNL     1       2.796  -1.458  -0.756  1.00  0.00           C  
HETATM    4  C   UNL     1       1.633   0.946  -0.144  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.416  -2.246   0.818  1.00  0.00           C  
HETATM    6  C   UNL     1       1.543  -3.527   0.701  1.00  0.00           C  
HETATM    7  C   UNL     1       0.484  -4.477   1.299  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.106  -3.489   2.886  1.00  0.00           C  
HETATM    9  C   UNL     1       0.853  -4.771   2.768  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.809   3.260   1.283  1.00  0.00           C  
HETATM   11  C   UNL     1       3.673   2.144  -0.835  1.00  0.00           C  
HETATM   12  C   UNL     1       1.501  -1.361  -0.250  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.813  -3.628   1.377  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.318   2.195   0.526  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.150   3.292   1.638  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.440   0.166  -3.602  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.995   2.272   1.243  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.508   1.218   0.492  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.174   1.176   0.134  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.824   5.660   2.722  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.436   0.109   0.065  1.00  0.00           C  
HETATM   22  C   UNL     1       4.938  -0.381  -1.500  1.00  0.00           C  
HETATM   23  F   UNL     1       5.008   0.332  -2.702  1.00  0.00           F  
HETATM   24  F   UNL     1       5.826   0.176  -0.575  1.00  0.00           F  
HETATM   25  F   UNL     1       5.281  -1.717  -1.731  1.00  0.00           F  
HETATM   26  N   UNL     1       0.964  -0.182   0.031  1.00  0.00           N  
HETATM   27  N   UNL     1       1.034   2.155   0.163  1.00  0.00           N  
HETATM   28  N   UNL     1       4.249   3.112  -0.985  1.00  0.00           N  
HETATM   29  N   UNL     1       0.759  -2.513  -0.050  1.00  0.00           N  
HETATM   30  N   UNL     1      -0.428  -4.654   3.510  1.00  0.00           N  
HETATM   31  O   UNL     1      -4.013   0.433  -1.202  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.458  -1.874  -2.124  1.00  0.00           O  
HETATM   33  O   UNL     1      -6.409  -0.644  -1.097  1.00  0.00           O  
HETATM   34  P   UNL     1      -5.056  -0.530  -1.962  1.00  0.00           P  
HETATM   35  S   UNL     1       0.272   4.554   1.791  1.00  0.00           S  
HETATM   36  H   UNL     1       3.218  -2.424  -0.989  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.233  -1.824   0.232  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.143  -1.572   1.630  1.00  0.00           H  
HETATM   39  H   UNL     1       2.118  -3.051   1.494  1.00  0.00           H  
HETATM   40  H   UNL     1       2.204  -4.073   0.027  1.00  0.00           H  
HETATM   41  H   UNL     1       0.363  -5.387   0.711  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.689  -2.558   3.269  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.179  -3.530   3.072  1.00  0.00           H  
HETATM   44  H   UNL     1       1.257  -5.779   2.864  1.00  0.00           H  
HETATM   45  H   UNL     1       1.573  -4.038   3.133  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.646  -4.072   0.832  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.533   4.114   2.225  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.524   0.244  -4.188  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.146  -0.486  -4.117  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.880   1.156  -3.483  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.038   2.299   1.521  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.797   0.351  -0.452  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.623   6.013   2.069  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.256   5.119   3.564  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.253   6.512   3.091  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.875  -0.822  -0.019  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.227  -0.008   0.805  1.00  0.00           H  
HETATM   58  H   UNL     1       1.550   2.976   0.126  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.264  -4.494   4.492  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.084  -1.210  -1.496  1.00  0.00           H  
CONECT    1    2    2    3   22                                       
CONECT    2    4   11    1    1                                       
CONECT    3   12   12    1   36                                       
CONECT    4   27   26   26    2                                       
CONECT    5   29   13   37   38                                       
CONECT    6   29    7   39   40                                       
CONECT    7   13    6    9   41                                       
CONECT    8   13   30   42   43                                       
CONECT    9    7   30   44   45                                       
CONECT   10   15   35   14   14                                       
CONECT   11   28   28   28    2                                       
CONECT   12   26   29    3    3                                       
CONECT   13    5    8    7   46                                       
CONECT   14   10   10   19   27                                       
CONECT   15   17   17   10   47                                       
CONECT   16   34   48   49   50                                       
CONECT   17   15   15   18   51                                       
CONECT   18   17   21   19   19                                       
CONECT   19   18   18   14   52                                       
CONECT   20   35   53   54   55                                       
CONECT   21   18   31   56   57                                       
CONECT   22   24    1   25   23                                       
CONECT   23   22                                                      
CONECT   24   22                                                      
CONECT   25   22                                                      
CONECT   26    4    4   12                                            
CONECT   27   14    4   58                                            
CONECT   28   11   11   11                                            
CONECT   29    5   12    6                                            
CONECT   30    8    9   59                                            
CONECT   31   21   34                                                 
CONECT   32   34   34                                                 
CONECT   33   34   60                                                 
CONECT   34   16   31   32   32                                       
CONECT   34   33                                                      
CONECT   35   20   10                                                 
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   27                                                      
CONECT   59   30                                                      
CONECT   60   33                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
