COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.228   0.048  -0.476  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.775   1.191   1.591  1.00  0.00           C  
HETATM    3  C   UNL     1       4.615  -0.079   0.214  1.00  0.00           C  
HETATM    4  C   UNL     1       5.675   0.426   1.195  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.508  -1.963  -1.226  1.00  0.00           C  
HETATM    6  N   UNL     1       1.023   0.495   0.160  1.00  0.00           N  
HETATM    7  C   UNL     1       2.261   0.066  -0.154  1.00  0.00           C  
HETATM    8  O   UNL     1       2.431  -0.642  -1.127  1.00  0.00           O  
HETATM    9  O   UNL     1       3.311   0.421   0.611  1.00  0.00           O  
HETATM   10  C   UNL     1       4.945   0.421  -1.194  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.038  -1.904   1.020  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.089  -1.256   0.397  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.889  -0.037  -0.218  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.626   0.549  -0.217  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.575  -0.113   0.414  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.780  -1.328   1.026  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.179   1.755  -0.764  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.865   1.957  -0.541  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.375   0.770   0.237  1.00  0.00           C  
HETATM   20  C   UNL     1       0.695   1.492   1.197  1.00  0.00           C  
HETATM   21  C   UNL     1       4.599  -1.609   0.221  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.207   2.911  -0.899  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.384  -1.466  -0.316  1.00  0.00           C  
HETATM   24  C   UNL     1       0.926  -2.157  -0.700  1.00  0.00           C  
HETATM   25  H   UNL     1      -0.223   0.312  -1.534  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.267   2.083   1.977  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.827   0.375   2.313  1.00  0.00           H  
HETATM   28  H   UNL     1       5.686   1.515   1.190  1.00  0.00           H  
HETATM   29  H   UNL     1       5.440   0.070   2.198  1.00  0.00           H  
HETATM   30  H   UNL     1       6.654   0.051   0.897  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.123  -2.105  -2.236  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.892  -2.910  -0.847  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.312  -1.227  -1.245  1.00  0.00           H  
HETATM   34  H   UNL     1       5.924   0.046  -1.493  1.00  0.00           H  
HETATM   35  H   UNL     1       4.190   0.062  -1.894  1.00  0.00           H  
HETATM   36  H   UNL     1       4.956   1.511  -1.200  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.200  -2.858   1.500  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.071  -1.705   0.392  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.714   0.464  -0.701  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.958  -1.833   1.512  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.747   2.374  -1.248  1.00  0.00           H  
HETATM   42  H   UNL     1       0.780   2.501   0.793  1.00  0.00           H  
HETATM   43  H   UNL     1       1.351   1.372   2.059  1.00  0.00           H  
HETATM   44  H   UNL     1       5.578  -1.983  -0.077  1.00  0.00           H  
HETATM   45  H   UNL     1       4.364  -1.964   1.224  1.00  0.00           H  
HETATM   46  H   UNL     1       3.844  -1.968  -0.478  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.626  -1.698   0.721  1.00  0.00           H  
HETATM   48  H   UNL     1       1.245  -1.809  -1.683  1.00  0.00           H  
HETATM   49  H   UNL     1       1.693  -1.917   0.036  1.00  0.00           H  
HETATM   50  H   UNL     1       0.774  -3.236  -0.728  1.00  0.00           H  
CONECT    1   23   19    6   25                                       
CONECT    2   19   20   26   27                                       
CONECT    3   21    9   10    4                                       
CONECT    4    3   28   29   30                                       
CONECT    5   23   31   32   33                                       
CONECT    6    1   20    7                                            
CONECT    7    6    9    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    7    3                                                 
CONECT   10    3   34   35   36                                       
CONECT   11   12   12   16   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   12   14   14   39                                       
CONECT   14   13   13   15   17                                       
CONECT   15   16   16   14   19                                       
CONECT   16   11   15   15   40                                       
CONECT   17   14   18   41                                            
CONECT   18   19   17   22   22                                       
CONECT   19   15    1    2   18                                       
CONECT   20    6    2   42   43                                       
CONECT   21    3   44   45   46                                       
CONECT   22   18   18                                                 
CONECT   23   24    5    1   47                                       
CONECT   24   23   48   49   50                                       
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
