COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.211  -3.368  -0.628  1.00  0.00           C  
HETATM    2  O   UNL     1      -5.971  -3.395  -1.577  1.00  0.00           O  
HETATM    3  O   UNL     1      -3.814   1.531   1.705  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.843  -2.078  -0.014  1.00  0.00           C  
HETATM    5  N   UNL     1      -4.708  -4.517  -0.135  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.009   1.641   0.164  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.122   1.742  -1.458  1.00  0.00           C  
HETATM    8  C   UNL     1       1.946   2.311  -0.279  1.00  0.00           C  
HETATM    9  C   UNL     1       2.889   1.263   0.322  1.00  0.00           C  
HETATM   10  C   UNL     1       3.795   0.708  -0.779  1.00  0.00           C  
HETATM   11  C   UNL     1       2.940   0.030  -1.852  1.00  0.00           C  
HETATM   12  C   UNL     1       1.998   1.063  -2.477  1.00  0.00           C  
HETATM   13  C   UNL     1       4.747  -0.299  -0.186  1.00  0.00           C  
HETATM   14  C   UNL     1       6.111  -0.094  -0.271  1.00  0.00           C  
HETATM   15  C   UNL     1       6.985  -1.016   0.273  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.367  -0.886  -0.520  1.00  0.00           C  
HETATM   17  C   UNL     1       6.493  -2.146   0.904  1.00  0.00           C  
HETATM   18  C   UNL     1       5.126  -2.351   0.988  1.00  0.00           C  
HETATM   19  C   UNL     1       4.254  -1.424   0.448  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.633  -0.839   1.651  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.974  -2.045   1.080  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.022   0.316   0.056  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.152   0.345   1.140  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.724   2.182   1.220  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.328   3.388   1.782  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.220   4.054   1.292  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.500   3.524   0.241  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.891   2.312  -0.331  1.00  0.00           C  
HETATM   29  F   UNL     1       7.346  -3.048   1.435  1.00  0.00           F  
HETATM   30  N   UNL     1       1.224   1.707  -1.407  1.00  0.00           N  
HETATM   31  O   UNL     1      -0.705   1.305  -2.431  1.00  0.00           O  
HETATM   32  H   UNL     1      -4.953  -5.365  -0.536  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.101  -4.496   0.622  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.314   0.701  -0.272  1.00  0.00           H  
HETATM   35  H   UNL     1       1.233   2.638   0.478  1.00  0.00           H  
HETATM   36  H   UNL     1       2.525   3.166  -0.629  1.00  0.00           H  
HETATM   37  H   UNL     1       3.500   1.725   1.097  1.00  0.00           H  
HETATM   38  H   UNL     1       2.303   0.452   0.755  1.00  0.00           H  
HETATM   39  H   UNL     1       4.362   1.523  -1.229  1.00  0.00           H  
HETATM   40  H   UNL     1       3.587  -0.386  -2.625  1.00  0.00           H  
HETATM   41  H   UNL     1       2.354  -0.770  -1.399  1.00  0.00           H  
HETATM   42  H   UNL     1       2.581   1.815  -3.009  1.00  0.00           H  
HETATM   43  H   UNL     1       1.319   0.567  -3.171  1.00  0.00           H  
HETATM   44  H   UNL     1       6.494   0.788  -0.764  1.00  0.00           H  
HETATM   45  H   UNL     1       8.051  -0.855   0.206  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.043  -0.907  -1.363  1.00  0.00           H  
HETATM   47  H   UNL     1       4.742  -3.230   1.484  1.00  0.00           H  
HETATM   48  H   UNL     1       3.188  -1.584   0.514  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.961  -0.813   2.496  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.570  -2.964   1.477  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.427   1.238  -0.335  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.888   3.807   2.605  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.917   4.992   1.733  1.00  0.00           H  
HETATM   54  H   UNL     1       0.365   4.047  -0.140  1.00  0.00           H  
CONECT    1    5    4    2    2                                       
CONECT    2    1    1                                                 
CONECT    3   23   24                                                 
CONECT    4   21    1   16   16                                       
CONECT    5    1   32   33                                            
CONECT    6   28   28   24   34                                       
CONECT    7   31   31   30   28                                       
CONECT    8   30    9   35   36                                       
CONECT    9   10    8   37   38                                       
CONECT   10   11   13    9   39                                       
CONECT   11   12   10   40   41                                       
CONECT   12   11   30   42   43                                       
CONECT   13   19   10   14   14                                       
CONECT   14   13   13   15   44                                       
CONECT   15   17   17   14   45                                       
CONECT   16    4    4   22   46                                       
CONECT   17   18   29   15   15                                       
CONECT   18   19   19   17   47                                       
CONECT   19   18   18   13   48                                       
CONECT   20   21   21   23   49                                       
CONECT   21   20   20    4   50                                       
CONECT   22   23   23   16   51                                       
CONECT   23   20    3   22   22                                       
CONECT   24    6    3   25   25                                       
CONECT   25   24   24   26   52                                       
CONECT   26   27   27   25   53                                       
CONECT   27   28   26   26   54                                       
CONECT   28    7    6    6   27                                       
CONECT   29   17                                                      
CONECT   30   12    7    8                                            
CONECT   31    7    7                                                 
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
