COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.095  -0.152  -0.085  1.00  0.00           C  
HETATM    2  O   UNL     1       6.846  -0.001   0.592  1.00  0.00           O  
HETATM    3  C   UNL     1       5.736  -0.445  -0.054  1.00  0.00           C  
HETATM    4  C   UNL     1       5.848  -1.014  -1.314  1.00  0.00           C  
HETATM    5  C   UNL     1       4.721  -1.466  -1.976  1.00  0.00           C  
HETATM    6  C   UNL     1       3.478  -1.355  -1.388  1.00  0.00           C  
HETATM    7  C   UNL     1       3.355  -0.785  -0.122  1.00  0.00           C  
HETATM    8  C   UNL     1       4.491  -0.334   0.548  1.00  0.00           C  
HETATM    9  F   UNL     1       4.380   0.214   1.778  1.00  0.00           F  
HETATM   10  C   UNL     1       2.019  -0.663   0.513  1.00  0.00           C  
HETATM   11  C   UNL     1       1.822  -1.109   1.819  1.00  0.00           C  
HETATM   12  C   UNL     1       0.578  -0.993   2.404  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.473  -0.437   1.697  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.283   0.007   0.401  1.00  0.00           C  
HETATM   15  C   UNL     1       0.958  -0.098  -0.192  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.434   0.611  -0.363  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.740   0.015   0.090  1.00  0.00           C  
HETATM   18  N   UNL     1      -3.310   0.041   1.241  1.00  0.00           N  
HETATM   19  C   UNL     1      -4.614  -0.611   1.410  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.735  -1.813   0.472  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.526  -1.359  -0.981  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.256  -0.619  -1.027  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.416  -0.441  -2.089  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.355   0.247  -1.789  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.667  -0.939  -3.346  1.00  0.00           N  
HETATM   26  F   UNL     1      -3.765  -2.764   0.807  1.00  0.00           F  
HETATM   27  F   UNL     1      -6.007  -2.381   0.604  1.00  0.00           F  
HETATM   28  C   UNL     1      -1.449   2.109  -0.196  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.747   2.927  -1.067  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.785   4.297  -0.883  1.00  0.00           C  
HETATM   31  N   UNL     1      -1.477   4.825   0.107  1.00  0.00           N  
HETATM   32  C   UNL     1      -2.156   4.077   0.955  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.170   2.701   0.830  1.00  0.00           C  
HETATM   34  H   UNL     1       8.897   0.242   0.540  1.00  0.00           H  
HETATM   35  H   UNL     1       8.275  -1.208  -0.284  1.00  0.00           H  
HETATM   36  H   UNL     1       8.066   0.396  -1.027  1.00  0.00           H  
HETATM   37  H   UNL     1       6.818  -1.103  -1.780  1.00  0.00           H  
HETATM   38  H   UNL     1       4.814  -1.908  -2.957  1.00  0.00           H  
HETATM   39  H   UNL     1       2.600  -1.709  -1.908  1.00  0.00           H  
HETATM   40  H   UNL     1       2.642  -1.544   2.371  1.00  0.00           H  
HETATM   41  H   UNL     1       1.106   0.252  -1.203  1.00  0.00           H  
HETATM   42  H   UNL     1       0.424  -1.338   3.416  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.445  -0.348   2.160  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.719  -0.947   2.442  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.406   0.103   1.185  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.474  -2.228  -1.637  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.346  -0.710  -1.288  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.476  -1.447  -3.514  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.034  -0.782  -4.065  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.178   2.500  -1.880  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.731   2.094   1.525  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.242   4.941  -1.558  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.711   4.546   1.754  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    8    8                                       
CONECT    4    3    5    5   37                                       
CONECT    5    4    4    6   38                                       
CONECT    6    5    7    7   39                                       
CONECT    7    6    6    8   10                                       
CONECT    8    3    3    7    9                                       
CONECT    9    8                                                      
CONECT   10    7   11   15   15                                       
CONECT   11   10   12   12   40                                       
CONECT   12   11   11   13   42                                       
CONECT   13   12   14   14   43                                       
CONECT   14   13   13   15   16                                       
CONECT   15   10   10   14   41                                       
CONECT   16   14   17   24   28                                       
CONECT   17   16   18   18   22                                       
CONECT   18   17   17   19                                            
CONECT   19   18   20   44   45                                       
CONECT   20   19   21   26   27                                       
CONECT   21   20   22   46   47                                       
CONECT   22   17   21   23                                            
CONECT   23   22   24   24   25                                       
CONECT   24   16   23   23                                            
CONECT   25   23   48   49                                            
CONECT   26   20                                                      
CONECT   27   20                                                      
CONECT   28   16   29   29   33                                       
CONECT   29   28   28   30   50                                       
CONECT   30   29   31   31   52                                       
CONECT   31   30   30   32                                            
CONECT   32   31   33   33   53                                       
CONECT   33   28   32   32   51                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40   11                                                      
CONECT   41   15                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   29                                                      
CONECT   51   33                                                      
CONECT   52   30                                                      
CONECT   53   32                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
