COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.860   1.156   0.074  1.00  0.00           C  
HETATM    2  C   UNL     1       4.478   0.938   0.086  1.00  0.00           C  
HETATM    3  C   UNL     1       3.866   2.197   0.237  1.00  0.00           C  
HETATM    4  C   UNL     1       4.845   3.123   0.311  1.00  0.00           C  
HETATM    5  C   UNL     1       3.983  -0.439  -0.048  1.00  0.00           C  
HETATM    6  C   UNL     1       2.532  -0.723  -0.041  1.00  0.00           C  
HETATM    7  C   UNL     1       0.758  -2.327  -0.161  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.538   1.143   0.231  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.877   0.917   0.236  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.389  -0.386   0.110  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.849  -0.605   0.118  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.071   0.247   0.159  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.880   1.223  -0.424  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.249   1.021  -0.511  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.640  -0.919   0.647  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.530  -1.468  -0.023  1.00  0.00           C  
HETATM   17  C   UNL     1       4.889  -1.448  -0.180  1.00  0.00           C  
HETATM   18  C   UNL     1       7.156  -2.315  -0.332  1.00  0.00           C  
HETATM   19  N   UNL     1       6.057   2.511   0.214  1.00  0.00           N  
HETATM   20  C   UNL     1       6.721   0.051  -0.072  1.00  0.00           C  
HETATM   21  O   UNL     1       7.928   0.223  -0.085  1.00  0.00           O  
HETATM   22  C   UNL     1       0.360   0.067   0.099  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.808  -0.145  -0.022  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.006  -1.112   0.554  1.00  0.00           C  
HETATM   25  C   UNL     1       2.092  -2.052  -0.166  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.147  -1.252  -0.029  1.00  0.00           C  
HETATM   27  N   UNL     1      -4.687   0.443   0.246  1.00  0.00           N  
HETATM   28  N   UNL     1      -6.312   2.403  -0.917  1.00  0.00           N  
HETATM   29  N   UNL     1       1.679   0.277   0.088  1.00  0.00           N  
HETATM   30  N   UNL     1       6.224  -1.193  -0.187  1.00  0.00           N  
HETATM   31  O   UNL     1      -4.295  -1.731   0.009  1.00  0.00           O  
HETATM   32  H   UNL     1       2.804   2.387   0.285  1.00  0.00           H  
HETATM   33  H   UNL     1       4.690   4.186   0.428  1.00  0.00           H  
HETATM   34  H   UNL     1       0.401  -3.342  -0.260  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.162   2.151   0.329  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.557   1.749   0.337  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.879   1.774  -0.961  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.017  -1.676   1.098  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.925  -2.468  -0.120  1.00  0.00           H  
HETATM   40  H   UNL     1       4.540  -2.465  -0.279  1.00  0.00           H  
HETATM   41  H   UNL     1       7.360  -2.483  -1.389  1.00  0.00           H  
HETATM   42  H   UNL     1       8.087  -2.083   0.185  1.00  0.00           H  
HETATM   43  H   UNL     1       6.714  -3.213   0.100  1.00  0.00           H  
HETATM   44  H   UNL     1       6.918   2.956   0.239  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.875  -0.301  -0.091  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.448  -2.022   0.934  1.00  0.00           H  
HETATM   47  H   UNL     1       2.809  -2.853  -0.266  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.331   1.332   0.397  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.354   2.543  -0.855  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.876   3.080  -1.322  1.00  0.00           H  
CONECT    1   20    2    2   19                                       
CONECT    2    5    1    1    3                                       
CONECT    3    2    4    4   32                                       
CONECT    4   19    3    3   33                                       
CONECT    5   17   17    6    2                                       
CONECT    6   25    5   29   29                                       
CONECT    7   25   25   26   34                                       
CONECT    8   22   22    9   35                                       
CONECT    9   10   10    8   36                                       
CONECT   10   16   11    9    9                                       
CONECT   11   31   31   10   27                                       
CONECT   12   27   15   15   13                                       
CONECT   13   12   28   14   14                                       
CONECT   14   13   13   23   37                                       
CONECT   15   12   12   24   38                                       
CONECT   16   26   26   10   39                                       
CONECT   17   30    5    5   40                                       
CONECT   18   30   41   42   43                                       
CONECT   19    1    4   44                                            
CONECT   20   30   21   21    1                                       
CONECT   21   20   20                                                 
CONECT   22   26   29    8    8                                       
CONECT   23   24   24   14   45                                       
CONECT   24   15   23   23   46                                       
CONECT   25    7    7    6   47                                       
CONECT   26    7   16   16   22                                       
CONECT   27   11   12   48                                            
CONECT   28   13   49   50                                            
CONECT   29    6    6   22                                            
CONECT   30   18   17   20                                            
CONECT   31   11   11                                                 
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
