COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.658   0.771  -0.147  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.199   2.713   1.030  1.00  0.00           C  
HETATM    3  C   UNL     1       2.281   1.300  -0.304  1.00  0.00           C  
HETATM    4  C   UNL     1       2.070   2.507  -0.979  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.433   1.480  -1.127  1.00  0.00           C  
HETATM    6  C   UNL     1       0.810   3.005  -1.130  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.286   2.309  -0.610  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.234   1.580   0.021  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.724   1.495   0.231  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.947   1.473  -0.903  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.723   2.658   1.170  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.623   2.545  -0.602  1.00  0.00           N  
HETATM   13  N   UNL     1      -1.332   0.658   0.456  1.00  0.00           N  
HETATM   14  C   UNL     1       4.603   1.474   0.631  1.00  0.00           C  
HETATM   15  N   UNL     1       5.272  -0.891  -0.612  1.00  0.00           N  
HETATM   16  C   UNL     1       6.890   1.700   1.587  1.00  0.00           C  
HETATM   17  C   UNL     1       5.862   0.970   0.762  1.00  0.00           C  
HETATM   18  O   UNL     1      -6.318   2.615  -0.129  1.00  0.00           O  
HETATM   19  C   UNL     1      -1.633  -0.570   1.196  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.872  -1.715   0.209  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.165  -2.912   0.931  1.00  0.00           O  
HETATM   22  C   UNL     1      -2.405  -4.049   0.099  1.00  0.00           C  
HETATM   23  F   UNL     1      -1.272  -4.304  -0.681  1.00  0.00           F  
HETATM   24  F   UNL     1      -2.682  -5.163   0.899  1.00  0.00           F  
HETATM   25  F   UNL     1      -3.498  -3.792  -0.737  1.00  0.00           F  
HETATM   26  C   UNL     1      -0.080   1.095   0.068  1.00  0.00           C  
HETATM   27  C   UNL     1       1.203   0.592   0.214  1.00  0.00           C  
HETATM   28  C   UNL     1       4.016  -0.400  -0.750  1.00  0.00           C  
HETATM   29  C   UNL     1       5.633  -2.150  -1.268  1.00  0.00           C  
HETATM   30  C   UNL     1       6.193  -0.236   0.120  1.00  0.00           C  
HETATM   31  O   UNL     1       7.318  -0.695   0.232  1.00  0.00           O  
HETATM   32  H   UNL     1      -3.742   2.701   2.019  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.914   3.625   0.506  1.00  0.00           H  
HETATM   34  H   UNL     1       2.913   3.050  -1.382  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.152   2.368  -1.694  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.142   0.587  -1.680  1.00  0.00           H  
HETATM   37  H   UNL     1       0.658   3.939  -1.652  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.965   0.583   0.778  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.457   1.506  -1.866  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.232   0.565  -0.372  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.005   1.766   1.729  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.071   3.544   1.701  1.00  0.00           H  
HETATM   43  H   UNL     1       4.332   2.400   1.117  1.00  0.00           H  
HETATM   44  H   UNL     1       6.842   1.351   2.619  1.00  0.00           H  
HETATM   45  H   UNL     1       7.884   1.505   1.184  1.00  0.00           H  
HETATM   46  H   UNL     1       6.689   2.770   1.556  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.793  -0.818   1.844  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.527  -0.420   1.801  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.712  -1.466  -0.439  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.978  -1.865  -0.396  1.00  0.00           H  
HETATM   51  H   UNL     1       1.365  -0.343   0.731  1.00  0.00           H  
HETATM   52  H   UNL     1       3.292  -0.941  -1.342  1.00  0.00           H  
HETATM   53  H   UNL     1       6.017  -1.942  -2.266  1.00  0.00           H  
HETATM   54  H   UNL     1       6.398  -2.659  -0.682  1.00  0.00           H  
HETATM   55  H   UNL     1       4.751  -2.786  -1.343  1.00  0.00           H  
CONECT    1   28   28    3   14                                       
CONECT    2    9   11   32   33                                       
CONECT    3    4    1   27   27                                       
CONECT    4    6    6    3   34                                       
CONECT    5    9   10   35   36                                       
CONECT    6    4    4    7   37                                       
CONECT    7    6   12   26   26                                       
CONECT    8   12   12   13    9                                       
CONECT    9    8    5    2   38                                       
CONECT   10    5   18   39   40                                       
CONECT   11    2   18   41   42                                       
CONECT   12    7    8    8                                            
CONECT   13   26    8   19                                            
CONECT   14    1   17   17   43                                       
CONECT   15   29   28   30                                            
CONECT   16   17   44   45   46                                       
CONECT   17   30   14   14   16                                       
CONECT   18   10   11                                                 
CONECT   19   13   20   47   48                                       
CONECT   20   19   21   49   50                                       
CONECT   21   20   22                                                 
CONECT   22   21   24   23   25                                       
CONECT   23   22                                                      
CONECT   24   22                                                      
CONECT   25   22                                                      
CONECT   26    7    7   27   13                                       
CONECT   27    3    3   26   51                                       
CONECT   28   15    1    1   52                                       
CONECT   29   15   53   54   55                                       
CONECT   30   15   31   31   17                                       
CONECT   31   30   30                                                 
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
