COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.853  -1.158  -0.316  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.278  -1.411  -0.982  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.325  -0.934  -0.152  1.00  0.00           C  
HETATM    4  N   UNL     1      -5.614  -0.998  -2.889  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.209  -0.889   1.241  1.00  0.00           C  
HETATM    6  O   UNL     1       0.468   0.454  -0.067  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.926   0.847  -1.388  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.775   1.269   0.340  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.009  -1.890  -0.400  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.816  -3.080   0.115  1.00  0.00           N  
HETATM   11  C   UNL     1      -5.593   4.410  -0.257  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.702   2.885  -0.069  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.532   2.148  -0.669  1.00  0.00           C  
HETATM   14  N   UNL     1       2.431  -0.357   0.583  1.00  0.00           N  
HETATM   15  N   UNL     1      -4.456   3.693  -0.840  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.661   0.218  -0.780  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.964   2.751   1.107  1.00  0.00           O  
HETATM   18  C   UNL     1      -6.250  -0.420   1.987  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.427   0.014   1.381  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.574  -0.018   0.027  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.522  -0.493  -0.771  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.617  -0.547  -2.171  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.479  -1.420  -2.354  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.539  -3.182   0.556  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.909  -1.954   0.290  1.00  0.00           C  
HETATM   26  C   UNL     1       0.434  -1.769   0.645  1.00  0.00           C  
HETATM   27  C   UNL     1       1.107  -0.486   0.363  1.00  0.00           C  
HETATM   28  C   UNL     1       3.099   0.916   0.304  1.00  0.00           C  
HETATM   29  C   UNL     1       2.956   1.843   1.513  1.00  0.00           C  
HETATM   30  C   UNL     1       1.481   2.195   1.715  1.00  0.00           C  
HETATM   31  C   UNL     1       1.339   3.122   2.924  1.00  0.00           C  
HETATM   32  C   UNL     1       4.560   0.668   0.031  1.00  0.00           C  
HETATM   33  C   UNL     1       5.205   1.369  -0.970  1.00  0.00           C  
HETATM   34  C   UNL     1       6.545   1.141  -1.220  1.00  0.00           C  
HETATM   35  C   UNL     1       7.240   0.211  -0.470  1.00  0.00           C  
HETATM   36  C   UNL     1       8.701  -0.038  -0.743  1.00  0.00           C  
HETATM   37  C   UNL     1       6.595  -0.490   0.532  1.00  0.00           C  
HETATM   38  C   UNL     1       5.256  -0.258   0.786  1.00  0.00           C  
HETATM   39  C   UNL     1       1.130  -2.806   1.266  1.00  0.00           C  
HETATM   40  C   UNL     1       0.501  -4.009   1.530  1.00  0.00           C  
HETATM   41  C   UNL     1      -0.816  -4.208   1.174  1.00  0.00           C  
HETATM   42  F   UNL     1       9.016  -1.363  -0.425  1.00  0.00           F  
HETATM   43  F   UNL     1       8.968   0.193  -2.097  1.00  0.00           F  
HETATM   44  F   UNL     1       9.476   0.826   0.039  1.00  0.00           F  
HETATM   45  H   UNL     1      -4.302  -1.222   1.723  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.853   0.408  -1.018  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.898   0.923  -2.475  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.815   1.685   0.648  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.386   0.945   1.182  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.241   5.062   0.542  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.079   5.009  -1.028  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.306   3.691   0.147  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.882   2.795  -1.259  1.00  0.00           H  
HETATM   54  H   UNL     1       2.941  -1.108   0.927  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.246   3.801  -1.781  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.772   0.335  -1.400  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.161  -0.384   3.062  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.237   0.380   1.995  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.492   0.322  -0.428  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.521  -0.216  -2.661  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.693  -1.780  -3.001  1.00  0.00           H  
HETATM   62  H   UNL     1       2.641   1.383  -0.568  1.00  0.00           H  
HETATM   63  H   UNL     1       3.334   1.339   2.403  1.00  0.00           H  
HETATM   64  H   UNL     1       3.528   2.755   1.341  1.00  0.00           H  
HETATM   65  H   UNL     1       1.103   2.698   0.825  1.00  0.00           H  
HETATM   66  H   UNL     1       0.910   1.283   1.887  1.00  0.00           H  
HETATM   67  H   UNL     1       0.288   3.373   3.067  1.00  0.00           H  
HETATM   68  H   UNL     1       1.717   2.619   3.814  1.00  0.00           H  
HETATM   69  H   UNL     1       1.910   4.034   2.752  1.00  0.00           H  
HETATM   70  H   UNL     1       4.662   2.095  -1.557  1.00  0.00           H  
HETATM   71  H   UNL     1       7.049   1.689  -2.003  1.00  0.00           H  
HETATM   72  H   UNL     1       7.138  -1.216   1.119  1.00  0.00           H  
HETATM   73  H   UNL     1       4.753  -0.803   1.571  1.00  0.00           H  
HETATM   74  H   UNL     1       2.165  -2.669   1.541  1.00  0.00           H  
HETATM   75  H   UNL     1       1.050  -4.804   2.011  1.00  0.00           H  
HETATM   76  H   UNL     1      -1.295  -5.152   1.387  1.00  0.00           H  
CONECT    1   25   16    9                                            
CONECT    2    3    3    9   23                                       
CONECT    3    5    2    2   21                                       
CONECT    4   23   23   22                                            
CONECT    5   18   18    3   45                                       
CONECT    6   27   27                                                 
CONECT    7   13   16   46   47                                       
CONECT    8   13   16   48   49                                       
CONECT    9    1   10   10    2                                       
CONECT   10   24    9    9                                            
CONECT   11   15   50   51   52                                       
CONECT   12   15   13   17   17                                       
CONECT   13    8   12    7   53                                       
CONECT   14   28   27   54                                            
CONECT   15   11   12   55                                            
CONECT   16    8    1    7   56                                       
CONECT   17   12   12                                                 
CONECT   18    5    5   19   57                                       
CONECT   19   18   20   20   58                                       
CONECT   20   19   19   21   59                                       
CONECT   21    3   20   22   22                                       
CONECT   22   21   21    4   60                                       
CONECT   23    2    4    4   61                                       
CONECT   24   25   25   41   10                                       
CONECT   25   26    1   24   24                                       
CONECT   26   27   39   39   25                                       
CONECT   27    6    6   14   26                                       
CONECT   28   29   32   14   62                                       
CONECT   29   30   28   63   64                                       
CONECT   30   31   29   65   66                                       
CONECT   31   30   67   68   69                                       
CONECT   32   28   38   38   33                                       
CONECT   33   32   34   34   70                                       
CONECT   34   33   33   35   71                                       
CONECT   35   37   37   34   36                                       
CONECT   36   35   42   44   43                                       
CONECT   37   38   35   35   72                                       
CONECT   38   32   32   37   73                                       
CONECT   39   26   26   40   74                                       
CONECT   40   39   41   41   75                                       
CONECT   41   40   40   24   76                                       
CONECT   42   36                                                      
CONECT   43   36                                                      
CONECT   44   36                                                      
CONECT   45    5                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   33                                                      
CONECT   71   34                                                      
CONECT   72   37                                                      
CONECT   73   38                                                      
CONECT   74   39                                                      
CONECT   75   40                                                      
CONECT   76   41                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
