COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.096  -3.669   0.091  1.00  0.00           O  
HETATM    2  C   UNL     1       3.817   0.679  -0.583  1.00  0.00           C  
HETATM    3  C   UNL     1       4.739   0.308  -1.575  1.00  0.00           C  
HETATM    4  C   UNL     1       2.552   1.198  -0.916  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.627   0.991  -0.320  1.00  0.00           N  
HETATM    6  C   UNL     1       1.704   1.532   0.102  1.00  0.00           C  
HETATM    7  C   UNL     1       2.103   1.355   1.425  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.792  -1.440  -0.115  1.00  0.00           N  
HETATM    9  C   UNL     1       0.340   2.092  -0.206  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.971   1.500  -0.621  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.702   1.834   0.691  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.206   1.988   0.365  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.666  -0.202   0.878  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.050  -0.746  -0.420  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.774   0.428  -1.366  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.012   0.983  -1.813  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.983  -2.431   0.953  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.638  -3.087   1.280  1.00  0.00           C  
HETATM   19  C   UNL     1       0.103  -2.731  -0.970  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.234  -2.072  -1.319  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.758   0.669   0.528  1.00  0.00           O  
HETATM   22  O   UNL     1      -2.676   0.639   1.510  1.00  0.00           O  
HETATM   23  C   UNL     1       5.951  -0.196  -1.213  1.00  0.00           C  
HETATM   24  N   UNL     1       3.283   0.872   1.731  1.00  0.00           N  
HETATM   25  C   UNL     1       4.159   0.525   0.783  1.00  0.00           C  
HETATM   26  C   UNL     1       5.420   0.001   1.117  1.00  0.00           C  
HETATM   27  C   UNL     1       6.289  -0.348   0.130  1.00  0.00           C  
HETATM   28  H   UNL     1       4.488   0.421  -2.620  1.00  0.00           H  
HETATM   29  H   UNL     1       2.259   1.329  -1.947  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.632   0.426   0.516  1.00  0.00           H  
HETATM   31  H   UNL     1       1.423   1.623   2.220  1.00  0.00           H  
HETATM   32  H   UNL     1       0.376   2.642  -1.146  1.00  0.00           H  
HETATM   33  H   UNL     1       0.033   2.763   0.596  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.895   2.397  -1.235  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.287   2.710   1.189  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.675   2.683   1.061  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.339   2.332  -0.660  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.993  -1.002   1.543  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.746  -1.441  -0.891  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.201   0.076  -2.224  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.913   1.732  -2.416  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.372  -1.937   1.843  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.688  -3.193   0.621  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.784  -3.863   2.031  1.00  0.00           H  
HETATM   45  H   UNL     1       0.051  -2.333   1.663  1.00  0.00           H  
HETATM   46  H   UNL     1       0.813  -1.967  -0.653  1.00  0.00           H  
HETATM   47  H   UNL     1       0.493  -3.250  -1.846  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.927  -2.828  -1.688  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.077  -1.316  -2.089  1.00  0.00           H  
HETATM   50  H   UNL     1       6.660  -0.481  -1.977  1.00  0.00           H  
HETATM   51  H   UNL     1       5.699  -0.123   2.153  1.00  0.00           H  
HETATM   52  H   UNL     1       7.257  -0.750   0.391  1.00  0.00           H  
CONECT    1   18   19                                                 
CONECT    2    4    3    3   25                                       
CONECT    3    2    2   23   28                                       
CONECT    4    6    6    2   29                                       
CONECT    5   10    9   30                                            
CONECT    6    9    4    4    7                                       
CONECT    7    6   24   24   31                                       
CONECT    8   17   20   14                                            
CONECT    9    5    6   32   33                                       
CONECT   10   15    5   11   34                                       
CONECT   11   22   10   12   35                                       
CONECT   12   11   21   36   37                                       
CONECT   13   14   22   21   38                                       
CONECT   14    8   15   13   39                                       
CONECT   15   16   14   10   40                                       
CONECT   16   15   41                                                 
CONECT   17   18    8   42   43                                       
CONECT   18    1   17   44   45                                       
CONECT   19    1   20   46   47                                       
CONECT   20    8   19   48   49                                       
CONECT   21   13   12                                                 
CONECT   22   13   11                                                 
CONECT   23    3   27   27   50                                       
CONECT   24    7    7   25                                            
CONECT   25    2   24   26   26                                       
CONECT   26   25   25   27   51                                       
CONECT   27   23   23   26   52                                       
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
