COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.412   0.682   0.257  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.774   0.360   0.047  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.689   1.423  -0.155  1.00  0.00           C  
HETATM    4  N   UNL     1      -3.228   2.683  -0.138  1.00  0.00           N  
HETATM    5  N   UNL     1      -1.063   1.962   0.255  1.00  0.00           N  
HETATM    6  C   UNL     1      -7.657   0.650  -0.777  1.00  0.00           C  
HETATM    7  O   UNL     1      -6.778  -0.459  -0.579  1.00  0.00           O  
HETATM    8  C   UNL     1      -5.465  -0.176  -0.374  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.043   1.135  -0.366  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.553  -1.223  -0.174  1.00  0.00           C  
HETATM   11  O   UNL     1      -4.993  -2.510  -0.186  1.00  0.00           O  
HETATM   12  C   UNL     1      -4.017  -3.531   0.024  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.228  -0.964   0.034  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.953   2.922   0.062  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.474  -0.308   0.465  1.00  0.00           N  
HETATM   16  C   UNL     1       0.884   0.020   0.545  1.00  0.00           C  
HETATM   17  C   UNL     1       1.761  -0.812   1.228  1.00  0.00           C  
HETATM   18  C   UNL     1       1.250  -2.066   1.889  1.00  0.00           C  
HETATM   19  C   UNL     1       3.102  -0.490   1.301  1.00  0.00           C  
HETATM   20  C   UNL     1       1.357   1.176  -0.064  1.00  0.00           C  
HETATM   21  C   UNL     1       2.697   1.499   0.014  1.00  0.00           C  
HETATM   22  C   UNL     1       3.573   0.664   0.693  1.00  0.00           C  
HETATM   23  O   UNL     1       4.893   0.981   0.766  1.00  0.00           O  
HETATM   24  C   UNL     1       5.761   0.284  -0.014  1.00  0.00           C  
HETATM   25  C   UNL     1       7.103   0.634  -0.044  1.00  0.00           C  
HETATM   26  C   UNL     1       7.984  -0.079  -0.834  1.00  0.00           C  
HETATM   27  C   UNL     1       7.529  -1.142  -1.593  1.00  0.00           C  
HETATM   28  C   UNL     1       6.192  -1.493  -1.564  1.00  0.00           C  
HETATM   29  C   UNL     1       5.307  -0.783  -0.776  1.00  0.00           C  
HETATM   30  H   UNL     1      -7.338   1.214  -1.653  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.673   0.286  -0.928  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.629   1.297   0.101  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.752   1.935  -0.521  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.499  -4.508  -0.011  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.257  -3.474  -0.756  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.548  -3.391   0.998  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.534  -1.778   0.187  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.616   3.948   0.069  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.756  -1.232   0.556  1.00  0.00           H  
HETATM   40  H   UNL     1       1.301  -2.895   1.183  1.00  0.00           H  
HETATM   41  H   UNL     1       1.863  -2.293   2.761  1.00  0.00           H  
HETATM   42  H   UNL     1       0.216  -1.917   2.201  1.00  0.00           H  
HETATM   43  H   UNL     1       3.784  -1.137   1.833  1.00  0.00           H  
HETATM   44  H   UNL     1       0.676   1.821  -0.600  1.00  0.00           H  
HETATM   45  H   UNL     1       3.064   2.397  -0.460  1.00  0.00           H  
HETATM   46  H   UNL     1       7.459   1.464   0.548  1.00  0.00           H  
HETATM   47  H   UNL     1       9.029   0.193  -0.858  1.00  0.00           H  
HETATM   48  H   UNL     1       8.219  -1.698  -2.210  1.00  0.00           H  
HETATM   49  H   UNL     1       5.839  -2.322  -2.158  1.00  0.00           H  
HETATM   50  H   UNL     1       4.264  -1.060  -0.750  1.00  0.00           H  
CONECT    1    5   15    2    2                                       
CONECT    2    1    1    3   13                                       
CONECT    3    4    4    2    9                                       
CONECT    4   14    3    3                                            
CONECT    5   14   14    1                                            
CONECT    6    7   30   31   32                                       
CONECT    7    8    6                                                 
CONECT    8    9    9   10    7                                       
CONECT    9    3    8    8   33                                       
CONECT   10   13   13    8   11                                       
CONECT   11   10   12                                                 
CONECT   12   11   34   35   36                                       
CONECT   13    2   10   10   37                                       
CONECT   14    5    5    4   38                                       
CONECT   15   16    1   39                                            
CONECT   16   17   17   20   15                                       
CONECT   17   19   18   16   16                                       
CONECT   18   17   40   41   42                                       
CONECT   19   22   22   17   43                                       
CONECT   20   21   21   16   44                                       
CONECT   21   22   20   20   45                                       
CONECT   22   23   19   19   21                                       
CONECT   23   24   22                                                 
CONECT   24   25   25   29   23                                       
CONECT   25   26   24   24   46                                       
CONECT   26   27   27   25   47                                       
CONECT   27   26   26   28   48                                       
CONECT   28   27   29   29   49                                       
CONECT   29   28   28   24   50                                       
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
