COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.361  -1.203  -0.033  1.00  0.00           N  
HETATM    2  C   UNL     1       1.097  -1.637  -1.076  1.00  0.00           C  
HETATM    3  C   UNL     1       2.504  -1.479  -1.047  1.00  0.00           C  
HETATM    4  C   UNL     1       3.077  -0.896   0.028  1.00  0.00           C  
HETATM    5  N   UNL     1       2.294  -0.470   1.066  1.00  0.00           N  
HETATM    6  C   UNL     1       0.959  -0.626   1.026  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.615  -2.503   0.465  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.984  -2.656   0.442  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.199  -0.486  -0.615  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.261   1.328   1.070  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.750   3.162   1.459  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.453   2.322  -0.763  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.784   2.372  -2.232  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.053   3.208   0.111  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.855   2.224   1.938  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.559   1.375  -0.284  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.975   0.496  -1.140  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.822  -0.345  -0.592  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.790  -1.648  -0.098  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.214  -1.803  -0.123  1.00  0.00           C  
HETATM   21  N   UNL     1      -6.343  -1.926  -0.144  1.00  0.00           N  
HETATM   22  F   UNL     1      -0.837  -3.477   0.986  1.00  0.00           F  
HETATM   23  C   UNL     1      -1.030  -1.349  -0.054  1.00  0.00           C  
HETATM   24  O   UNL     1       0.558  -2.159  -2.035  1.00  0.00           O  
HETATM   25  O   UNL     1       0.282  -0.240   1.959  1.00  0.00           O  
HETATM   26  S   UNL     1       4.825  -0.686   0.093  1.00  0.00           S  
HETATM   27  O   UNL     1       5.225  -1.054   1.406  1.00  0.00           O  
HETATM   28  O   UNL     1       5.347  -1.298  -1.078  1.00  0.00           O  
HETATM   29  C   UNL     1       5.150   1.039  -0.060  1.00  0.00           C  
HETATM   30  C   UNL     1       5.218   1.832   1.069  1.00  0.00           C  
HETATM   31  C   UNL     1       5.473   3.186   0.949  1.00  0.00           C  
HETATM   32  C   UNL     1       5.658   3.746  -0.301  1.00  0.00           C  
HETATM   33  C   UNL     1       5.590   2.952  -1.431  1.00  0.00           C  
HETATM   34  C   UNL     1       5.341   1.598  -1.310  1.00  0.00           C  
HETATM   35  H   UNL     1       3.110  -1.820  -1.873  1.00  0.00           H  
HETATM   36  H   UNL     1       2.706  -0.052   1.838  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.434  -3.553   0.841  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.561   0.595   1.444  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.214   3.861   2.140  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.097   3.051  -2.737  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.689   1.374  -2.660  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.807   2.727  -2.363  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.749   3.944  -0.261  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.620   2.190   2.992  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.365   0.549  -0.990  1.00  0.00           H  
HETATM   46  H   UNL     1       5.073   1.395   2.046  1.00  0.00           H  
HETATM   47  H   UNL     1       5.526   3.806   1.832  1.00  0.00           H  
HETATM   48  H   UNL     1       5.857   4.803  -0.396  1.00  0.00           H  
HETATM   49  H   UNL     1       5.735   3.389  -2.408  1.00  0.00           H  
HETATM   50  H   UNL     1       5.292   0.977  -2.193  1.00  0.00           H  
CONECT    1    2   23    6                                            
CONECT    2   24   24    3    1                                       
CONECT    3    2    4    4   35                                       
CONECT    4    3    3   26    5                                       
CONECT    5    4    6   36                                            
CONECT    6    1    5   25   25                                       
CONECT    7    8    8   23   22                                       
CONECT    8   19    7    7   37                                       
CONECT    9   17   19   19   18                                       
CONECT   10   16   16   15   38                                       
CONECT   11   14   15   15   39                                       
CONECT   12   13   14   14   16                                       
CONECT   13   12   40   41   42                                       
CONECT   14   12   12   11   43                                       
CONECT   15   11   11   10   44                                       
CONECT   16   12   17   10   10                                       
CONECT   17   16    9                                                 
CONECT   18    9   23   23   45                                       
CONECT   19   20    9    9    8                                       
CONECT   20   21   21   21   19                                       
CONECT   21   20   20   20                                            
CONECT   22    7                                                      
CONECT   23   18   18    7    1                                       
CONECT   24    2    2                                                 
CONECT   25    6    6                                                 
CONECT   26   27   27    4   28                                       
CONECT   26   28   29                                                 
CONECT   27   26   26                                                 
CONECT   28   26   26                                                 
CONECT   29   26   34   34   30                                       
CONECT   30   29   31   31   46                                       
CONECT   31   30   30   32   47                                       
CONECT   32   33   33   31   48                                       
CONECT   33   34   32   32   49                                       
CONECT   34   29   29   33   50                                       
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    8                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   18                                                      
CONECT   46   30                                                      
CONECT   47   31                                                      
CONECT   48   32                                                      
CONECT   49   33                                                      
CONECT   50   34                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
