COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.706   2.075  -0.526  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.647   0.878   0.323  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.292   0.191   0.142  1.00  0.00           C  
HETATM    4  O   UNL     1      -0.235  -0.974   0.968  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.766  -0.087  -0.077  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.123   0.554   0.221  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.241  -0.411  -0.179  1.00  0.00           C  
HETATM    8  N   UNL     1      -6.540   0.203   0.106  1.00  0.00           N  
HETATM    9  C   UNL     1      -7.694  -0.478  -0.171  1.00  0.00           C  
HETATM   10  N   UNL     1      -7.636  -1.699  -0.700  1.00  0.00           N  
HETATM   11  N   UNL     1      -8.875   0.080   0.089  1.00  0.00           N1+
HETATM   12  C   UNL     1       0.826   1.155   0.542  1.00  0.00           C  
HETATM   13  N   UNL     1       2.125   0.541   0.257  1.00  0.00           N1+
HETATM   14  C   UNL     1       2.679   0.730  -0.925  1.00  0.00           C  
HETATM   15  C   UNL     1       3.903   0.167  -1.230  1.00  0.00           C  
HETATM   16  C   UNL     1       4.550  -0.603  -0.275  1.00  0.00           C  
HETATM   17  C   UNL     1       3.937  -0.778   0.957  1.00  0.00           C  
HETATM   18  C   UNL     1       2.714  -0.180   1.191  1.00  0.00           C  
HETATM   19  C   UNL     1       5.886  -1.235  -0.568  1.00  0.00           C  
HETATM   20  C   UNL     1       6.988  -0.285  -0.175  1.00  0.00           C  
HETATM   21  O   UNL     1       6.716   0.795   0.295  1.00  0.00           O  
HETATM   22  O   UNL     1       8.272  -0.637  -0.348  1.00  0.00           O  
HETATM   23  H   UNL     1      -1.593   1.834  -1.499  1.00  0.00           H  
HETATM   24  H   UNL     1      -1.772   1.166   1.367  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.693  -0.306  -1.142  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.668  -1.012   0.491  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.195   0.773   1.286  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.220   1.479  -0.347  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.168  -0.629  -1.244  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.143  -1.336   0.389  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.583   1.092   0.491  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.775  -2.105  -0.888  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.454  -2.182  -0.896  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.693  -0.403  -0.108  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.918   0.969   0.474  1.00  0.00           H  
HETATM   36  H   UNL     1       0.729   2.080  -0.026  1.00  0.00           H  
HETATM   37  H   UNL     1       0.753   1.374   1.608  1.00  0.00           H  
HETATM   38  H   UNL     1       2.169   1.330  -1.664  1.00  0.00           H  
HETATM   39  H   UNL     1       4.351   0.324  -2.200  1.00  0.00           H  
HETATM   40  H   UNL     1       4.412  -1.372   1.724  1.00  0.00           H  
HETATM   41  H   UNL     1       2.232  -0.308   2.149  1.00  0.00           H  
HETATM   42  H   UNL     1       5.984  -2.159   0.000  1.00  0.00           H  
HETATM   43  H   UNL     1       5.958  -1.454  -1.634  1.00  0.00           H  
HETATM   44  H   UNL     1       8.943   0.005  -0.081  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.566   2.582  -0.377  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.168  -0.098  -0.901  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.339  -0.792   1.912  1.00  0.00           H  
CONECT    1    2   23   45                                            
CONECT    2    1    3    5   24                                       
CONECT    3    2    4   12   46                                       
CONECT    4    3   47                                                 
CONECT    5    2    6   25   26                                       
CONECT    6    5    7   27   28                                       
CONECT    7    6    8   29   30                                       
CONECT    8    7    9   31                                            
CONECT    9    8   10   11   11                                       
CONECT   10    9   32   33                                            
CONECT   11    9    9   34   35                                       
CONECT   12    3   13   36   37                                       
CONECT   13   12   14   18   18                                       
CONECT   14   13   15   15   38                                       
CONECT   15   14   14   16   39                                       
CONECT   16   15   17   17   19                                       
CONECT   17   16   16   18   40                                       
CONECT   18   13   13   17   41                                       
CONECT   19   16   20   42   43                                       
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   44                                                 
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45    1                                                      
CONECT   46    3                                                      
CONECT   47    4                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
