COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.531   4.410   1.137  1.00  0.00           C  
HETATM    2  C   UNL     1       4.372   3.251   0.667  1.00  0.00           C  
HETATM    3  O   UNL     1       5.566   3.393   0.510  1.00  0.00           O  
HETATM    4  N   UNL     1       3.798   2.057   0.422  1.00  0.00           N  
HETATM    5  C   UNL     1       2.468   1.788   0.559  1.00  0.00           C  
HETATM    6  C   UNL     1       4.472   0.926  -0.012  1.00  0.00           C  
HETATM    7  C   UNL     1       5.806   0.670  -0.306  1.00  0.00           C  
HETATM    8  C   UNL     1       6.191  -0.584  -0.727  1.00  0.00           C  
HETATM    9  C   UNL     1       5.253  -1.603  -0.862  1.00  0.00           C  
HETATM   10  O   UNL     1       5.647  -2.836  -1.279  1.00  0.00           O  
HETATM   11  C   UNL     1       7.037  -3.013  -1.560  1.00  0.00           C  
HETATM   12  C   UNL     1       3.922  -1.365  -0.573  1.00  0.00           C  
HETATM   13  C   UNL     1       3.525  -0.101  -0.148  1.00  0.00           C  
HETATM   14  C   UNL     1       2.227   0.490   0.231  1.00  0.00           C  
HETATM   15  C   UNL     1       0.924  -0.192   0.248  1.00  0.00           C  
HETATM   16  O   UNL     1       0.847  -1.363  -0.070  1.00  0.00           O  
HETATM   17  N   UNL     1      -0.184   0.481   0.615  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.437  -0.139   0.541  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.561   0.605   0.198  1.00  0.00           C  
HETATM   20  F   UNL     1      -2.442   1.925  -0.063  1.00  0.00           F  
HETATM   21  C   UNL     1      -1.554  -1.494   0.804  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.803  -2.116   0.725  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.927  -3.561   1.000  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.837  -4.280   1.333  1.00  0.00           O  
HETATM   25  O   UNL     1      -4.012  -4.102   0.927  1.00  0.00           O  
HETATM   26  C   UNL     1      -3.931  -1.371   0.381  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.810  -0.011   0.123  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.010   0.785  -0.244  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.923   0.469  -1.207  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.414   1.999   0.344  1.00  0.00           C  
HETATM   31  N   UNL     1      -6.513   2.390  -0.246  1.00  0.00           N  
HETATM   32  N   UNL     1      -6.853   1.446  -1.223  1.00  0.00           N  
HETATM   33  C   UNL     1      -8.017   1.509  -2.109  1.00  0.00           C  
HETATM   34  H   UNL     1       4.165   5.285   1.281  1.00  0.00           H  
HETATM   35  H   UNL     1       2.770   4.633   0.389  1.00  0.00           H  
HETATM   36  H   UNL     1       3.049   4.151   2.080  1.00  0.00           H  
HETATM   37  H   UNL     1       1.720   2.498   0.880  1.00  0.00           H  
HETATM   38  H   UNL     1       6.541   1.455  -0.204  1.00  0.00           H  
HETATM   39  H   UNL     1       7.229  -0.778  -0.955  1.00  0.00           H  
HETATM   40  H   UNL     1       7.215  -4.039  -1.883  1.00  0.00           H  
HETATM   41  H   UNL     1       7.338  -2.326  -2.352  1.00  0.00           H  
HETATM   42  H   UNL     1       7.618  -2.808  -0.661  1.00  0.00           H  
HETATM   43  H   UNL     1       3.194  -2.156  -0.678  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.114   1.396   0.931  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.680  -2.070   1.070  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.968  -5.222   1.504  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.897  -1.850   0.319  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.905  -0.405  -1.841  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.903   2.519   1.141  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.751   2.042  -3.022  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.338   0.498  -2.360  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.830   2.033  -1.606  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    4    3    3                                       
CONECT    3    2    2                                                 
CONECT    4    5    2    6                                            
CONECT    5   14   14    4   37                                       
CONECT    6    4   13   13    7                                       
CONECT    7    6    8    8   38                                       
CONECT    8    7    7    9   39                                       
CONECT    9   12   12    8   10                                       
CONECT   10    9   11                                                 
CONECT   11   10   40   41   42                                       
CONECT   12   13    9    9   43                                       
CONECT   13   14    6    6   12                                       
CONECT   14   15    5    5   13                                       
CONECT   15   17   16   16   14                                       
CONECT   16   15   15                                                 
CONECT   17   18   15   44                                            
CONECT   18   21   21   19   17                                       
CONECT   19   27   27   18   20                                       
CONECT   20   19                                                      
CONECT   21   22   18   18   45                                       
CONECT   22   23   26   26   21                                       
CONECT   23   25   25   24   22                                       
CONECT   24   23   46                                                 
CONECT   25   23   23                                                 
CONECT   26   22   22   27   47                                       
CONECT   27   26   28   19   19                                       
CONECT   28   30   27   29   29                                       
CONECT   29   28   28   32   48                                       
CONECT   30   31   31   28   49                                       
CONECT   31   30   30   32                                            
CONECT   32   31   29   33                                            
CONECT   33   32   50   51   52                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   17                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
CONECT   47   26                                                      
CONECT   48   29                                                      
CONECT   49   30                                                      
CONECT   50   33                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
