COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.063   2.963   0.059  1.00  0.00           N  
HETATM    2  C   UNL     1      -6.611  -0.097  -1.280  1.00  0.00           C  
HETATM    3  O   UNL     1      -5.309   0.212  -0.779  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.774  -0.652   0.123  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.974   2.173   0.653  1.00  0.00           C  
HETATM    6  C   UNL     1       0.272  -0.559  -1.036  1.00  0.00           C  
HETATM    7  C   UNL     1       1.016   0.209  -0.143  1.00  0.00           C  
HETATM    8  C   UNL     1       2.336  -0.075   0.069  1.00  0.00           C  
HETATM    9  C   UNL     1       2.940  -1.138  -0.612  1.00  0.00           C  
HETATM   10  C   UNL     1       2.189  -1.907  -1.508  1.00  0.00           C  
HETATM   11  C   UNL     1       0.870  -1.618  -1.715  1.00  0.00           C  
HETATM   12  C   UNL     1       4.363  -1.446  -0.385  1.00  0.00           C  
HETATM   13  C   UNL     1       5.269  -0.406   0.146  1.00  0.00           C  
HETATM   14  C   UNL     1       6.457  -0.770   0.784  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.485  -1.773   0.518  1.00  0.00           C  
HETATM   16  C   UNL     1       7.298   0.205   1.277  1.00  0.00           C  
HETATM   17  C   UNL     1       6.967   1.542   1.142  1.00  0.00           C  
HETATM   18  C   UNL     1       5.791   1.910   0.512  1.00  0.00           C  
HETATM   19  C   UNL     1       4.944   0.945   0.008  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.939  -2.652   1.435  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.681  -2.420   1.964  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.960  -1.308   1.582  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.498  -0.416   0.652  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.731   0.777   0.238  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.654   0.807  -0.608  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.244   2.226  -0.712  1.00  0.00           C  
HETATM   27  N   UNL     1      -1.071  -0.272  -1.245  1.00  0.00           N  
HETATM   28  O   UNL     1      -3.852   2.546   1.406  1.00  0.00           O  
HETATM   29  O   UNL     1      -0.321   2.651  -1.376  1.00  0.00           O  
HETATM   30  O   UNL     1       4.793  -2.556  -0.637  1.00  0.00           O  
HETATM   31  H   UNL     1      -2.006   3.925   0.168  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.587  -1.065  -1.780  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.319  -0.133  -0.452  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.919   0.671  -1.989  1.00  0.00           H  
HETATM   35  H   UNL     1       0.550   1.029   0.382  1.00  0.00           H  
HETATM   36  H   UNL     1       2.912   0.521   0.761  1.00  0.00           H  
HETATM   37  H   UNL     1       2.653  -2.728  -2.035  1.00  0.00           H  
HETATM   38  H   UNL     1       0.289  -2.214  -2.403  1.00  0.00           H  
HETATM   39  H   UNL     1       6.717  -1.813   0.890  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.467  -1.961   0.109  1.00  0.00           H  
HETATM   41  H   UNL     1       8.217  -0.075   1.770  1.00  0.00           H  
HETATM   42  H   UNL     1       7.629   2.302   1.531  1.00  0.00           H  
HETATM   43  H   UNL     1       5.539   2.955   0.410  1.00  0.00           H  
HETATM   44  H   UNL     1       4.027   1.233  -0.484  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.497  -3.525   1.740  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.264  -3.109   2.683  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.979  -1.130   1.997  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.599  -0.829  -1.838  1.00  0.00           H  
CONECT    1   26    5   31                                            
CONECT    2    3   32   33   34                                       
CONECT    3    4    2                                                 
CONECT    4   23   23   15    3                                       
CONECT    5   24    1   28   28                                       
CONECT    6    7    7   11   27                                       
CONECT    7    8    6    6   35                                       
CONECT    8    9    9    7   36                                       
CONECT    9   12    8    8   10                                       
CONECT   10    9   11   11   37                                       
CONECT   11   10   10    6   38                                       
CONECT   12   30   30   13    9                                       
CONECT   13   19   12   14   14                                       
CONECT   14   13   13   16   39                                       
CONECT   15   20   20    4   40                                       
CONECT   16   17   17   14   41                                       
CONECT   17   18   16   16   42                                       
CONECT   18   19   19   17   43                                       
CONECT   19   18   18   13   44                                       
CONECT   20   21   15   15   45                                       
CONECT   21   22   22   20   46                                       
CONECT   22   21   21   23   47                                       
CONECT   23   22   24    4    4                                       
CONECT   24   25   25   23    5                                       
CONECT   25   27   26   24   24                                       
CONECT   26   25   29   29    1                                       
CONECT   27    6   25   48                                            
CONECT   28    5    5                                                 
CONECT   29   26   26                                                 
CONECT   30   12   12                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
