COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       3.509  -2.664  -1.552  1.00  0.00           C  
HETATM    2  C   UNL     1       3.565  -0.540  -0.486  1.00  0.00           C  
HETATM    3  C   UNL     1       4.803  -0.896   0.031  1.00  0.00           C  
HETATM    4  C   UNL     1       5.488  -0.015   0.845  1.00  0.00           C  
HETATM    5  C   UNL     1       7.292   3.961   1.984  1.00  0.00           C  
HETATM    6  C   UNL     1       1.675   1.088  -0.743  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.678   0.676  -0.262  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.084  -0.391   0.443  1.00  0.00           C  
HETATM    9  N   UNL     1      -5.184   0.285   0.076  1.00  0.00           N  
HETATM   10  C   UNL     1      -4.835   1.485  -0.353  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.576   2.581  -0.842  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.624   3.787  -1.115  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.050  -1.773   0.978  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.986  -2.618   0.667  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.959  -3.903   1.168  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.986  -4.354   1.978  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.045  -3.520   2.290  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.079  -2.231   1.800  1.00  0.00           C  
HETATM   19  F   UNL     1       4.735  -2.451  -2.189  1.00  0.00           F  
HETATM   20  F   UNL     1       2.679  -3.427  -2.381  1.00  0.00           F  
HETATM   21  F   UNL     1       3.720  -3.347  -0.349  1.00  0.00           F  
HETATM   22  O   UNL     1       2.886  -1.407  -1.283  1.00  0.00           O  
HETATM   23  C   UNL     1       4.942   1.219   1.145  1.00  0.00           C  
HETATM   24  C   UNL     1       5.692   2.177   2.035  1.00  0.00           C  
HETATM   25  O   UNL     1       6.533   3.011   1.234  1.00  0.00           O  
HETATM   26  C   UNL     1       3.709   1.576   0.631  1.00  0.00           C  
HETATM   27  C   UNL     1       3.019   0.699  -0.184  1.00  0.00           C  
HETATM   28  N   UNL     1       0.615   0.467   0.055  1.00  0.00           N  
HETATM   29  O   UNL     1      -0.965   1.380  -1.211  1.00  0.00           O  
HETATM   30  N   UNL     1      -1.653   0.105   0.472  1.00  0.00           N  
HETATM   31  C   UNL     1      -2.988   0.425   0.228  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.076   2.491  -0.951  1.00  0.00           C  
HETATM   33  N   UNL     1      -4.954   3.678  -1.201  1.00  0.00           N  
HETATM   34  C   UNL     1      -2.866   2.769  -0.659  1.00  0.00           C  
HETATM   35  N   UNL     1      -3.464   1.600  -0.266  1.00  0.00           N  
HETATM   36  H   UNL     1       5.229  -1.860  -0.203  1.00  0.00           H  
HETATM   37  H   UNL     1       6.451  -0.291   1.248  1.00  0.00           H  
HETATM   38  H   UNL     1       7.904   4.554   1.305  1.00  0.00           H  
HETATM   39  H   UNL     1       6.615   4.617   2.531  1.00  0.00           H  
HETATM   40  H   UNL     1       7.937   3.436   2.689  1.00  0.00           H  
HETATM   41  H   UNL     1       1.568   2.172  -0.710  1.00  0.00           H  
HETATM   42  H   UNL     1       1.599   0.747  -1.776  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.147   4.705  -1.424  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.184  -2.267   0.034  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.135  -4.558   0.928  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.961  -5.361   2.368  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.844  -3.878   2.922  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.904  -1.579   2.048  1.00  0.00           H  
HETATM   49  H   UNL     1       4.981   2.797   2.582  1.00  0.00           H  
HETATM   50  H   UNL     1       6.303   1.615   2.741  1.00  0.00           H  
HETATM   51  H   UNL     1       3.285   2.540   0.868  1.00  0.00           H  
HETATM   52  H   UNL     1       0.844  -0.094   0.812  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.426  -0.528   1.171  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.529   2.835  -0.021  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.418   3.118  -1.775  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.366   1.457  -1.136  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.793   2.875  -0.604  1.00  0.00           H  
CONECT    1   20   22   21   19                                       
CONECT    2   22   27   27    3                                       
CONECT    3    2    4    4   36                                       
CONECT    4    3    3   23   37                                       
CONECT    5   25   38   39   40                                       
CONECT    6   28   27   41   42                                       
CONECT    7   29   29   30   28                                       
CONECT    8    9   31   31   13                                       
CONECT    9   10   10    8                                            
CONECT   10   11   35    9    9                                       
CONECT   11   33   33   32   10                                       
CONECT   12   33   34   34   43                                       
CONECT   13    8   14   14   18                                       
CONECT   14   13   13   15   44                                       
CONECT   15   14   16   16   45                                       
CONECT   16   15   15   17   46                                       
CONECT   17   18   18   16   47                                       
CONECT   18   13   17   17   48                                       
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    1                                                      
CONECT   22    1    2                                                 
CONECT   23   26   26    4   24                                       
CONECT   24   23   25   49   50                                       
CONECT   25   24    5                                                 
CONECT   26   27   23   23   51                                       
CONECT   27    6    2    2   26                                       
CONECT   28    7    6   52                                            
CONECT   29    7    7                                                 
CONECT   30    7   31   53                                            
CONECT   31   35    8    8   30                                       
CONECT   32   11   54   55   56                                       
CONECT   33   12   11   11                                            
CONECT   34   12   12   35   57                                       
CONECT   35   34   10   31                                            
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   30                                                      
CONECT   54   32                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   34                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
