COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.621  -0.812   0.125  1.00  0.00           C  
HETATM    2  C   UNL     1       4.661   1.602   2.191  1.00  0.00           C  
HETATM    3  C   UNL     1       3.917   0.633   1.543  1.00  0.00           C  
HETATM    4  C   UNL     1       4.040   0.465   0.177  1.00  0.00           C  
HETATM    5  C   UNL     1       4.908   1.265  -0.542  1.00  0.00           C  
HETATM    6  C   UNL     1       5.651   2.235   0.104  1.00  0.00           C  
HETATM    7  C   UNL     1       5.528   2.402   1.471  1.00  0.00           C  
HETATM    8  C   UNL     1       6.597   3.107  -0.680  1.00  0.00           C  
HETATM    9  N   UNL     1       5.887   4.308  -1.141  1.00  0.00           N  
HETATM   10  C   UNL     1       3.230  -0.592  -0.528  1.00  0.00           C  
HETATM   11  C   UNL     1       3.576  -1.968   0.047  1.00  0.00           C  
HETATM   12  C   UNL     1       2.776  -3.043  -0.695  1.00  0.00           C  
HETATM   13  N   UNL     1       1.349  -2.702  -0.628  1.00  0.00           N  
HETATM   14  C   UNL     1       0.919  -1.369  -1.071  1.00  0.00           C  
HETATM   15  C   UNL     1       1.739  -0.312  -0.324  1.00  0.00           C  
HETATM   16  C   UNL     1       0.450  -3.595  -0.168  1.00  0.00           C  
HETATM   17  O   UNL     1       0.799  -4.734   0.086  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.945  -3.196   0.027  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.432  -1.943  -0.094  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.754  -1.952   0.156  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.134  -3.249   0.446  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.986  -4.038   0.359  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.331   0.122   0.101  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.197   1.262   0.071  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.560   1.117   0.350  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.387   2.220   0.320  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.874   3.468   0.013  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.528   3.622  -0.265  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.683   2.529  -0.233  1.00  0.00           C  
HETATM   30  F   UNL     1      -3.367   2.681  -0.500  1.00  0.00           F  
HETATM   31  H   UNL     1       4.561   1.737   3.257  1.00  0.00           H  
HETATM   32  H   UNL     1       3.239   0.007   2.106  1.00  0.00           H  
HETATM   33  H   UNL     1       6.110   3.159   1.977  1.00  0.00           H  
HETATM   34  H   UNL     1       5.005   1.133  -1.610  1.00  0.00           H  
HETATM   35  H   UNL     1       3.460  -0.576  -1.593  1.00  0.00           H  
HETATM   36  H   UNL     1       7.432   3.401  -0.044  1.00  0.00           H  
HETATM   37  H   UNL     1       6.972   2.554  -1.541  1.00  0.00           H  
HETATM   38  H   UNL     1       5.475   4.804  -0.366  1.00  0.00           H  
HETATM   39  H   UNL     1       6.501   4.910  -1.670  1.00  0.00           H  
HETATM   40  H   UNL     1       4.642  -2.157  -0.077  1.00  0.00           H  
HETATM   41  H   UNL     1       3.322  -1.993   1.107  1.00  0.00           H  
HETATM   42  H   UNL     1       3.094  -3.080  -1.737  1.00  0.00           H  
HETATM   43  H   UNL     1       2.943  -4.012  -0.226  1.00  0.00           H  
HETATM   44  H   UNL     1       1.085  -1.269  -2.144  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.140  -1.233  -0.849  1.00  0.00           H  
HETATM   46  H   UNL     1       1.503  -0.353   0.739  1.00  0.00           H  
HETATM   47  H   UNL     1       1.499   0.677  -0.713  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.924  -5.104   0.522  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.130  -3.588   0.690  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.963   0.144   0.589  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.439   2.108   0.536  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.528   4.327  -0.009  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.135   4.600  -0.504  1.00  0.00           H  
CONECT    1   20   23   23   23                                       
CONECT    2    3    7    7   31                                       
CONECT    3    2    4    4   32                                       
CONECT    4    3    3    5   10                                       
CONECT    5    4    6    6   34                                       
CONECT    6    5    5    7    8                                       
CONECT    7    2    2    6   33                                       
CONECT    8    6    9   36   37                                       
CONECT    9    8   38   39                                            
CONECT   10    4   11   15   35                                       
CONECT   11   10   12   40   41                                       
CONECT   12   11   13   42   43                                       
CONECT   13   12   14   16                                            
CONECT   14   13   15   44   45                                       
CONECT   15   10   14   46   47                                       
CONECT   16   13   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   22   22                                       
CONECT   19   18   20                                                 
CONECT   20    1   19   21   21                                       
CONECT   21   20   20   22   49                                       
CONECT   22   18   18   21   48                                       
CONECT   23    1    1    1   24                                       
CONECT   24   23   25   29   29                                       
CONECT   25   24   26   26   50                                       
CONECT   26   25   25   27   51                                       
CONECT   27   26   28   28   52                                       
CONECT   28   27   27   29   53                                       
CONECT   29   24   24   28   30                                       
CONECT   30   29                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    7                                                      
CONECT   34    5                                                      
CONECT   35   10                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   22                                                      
CONECT   49   21                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
