COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.607   4.966   0.980  1.00  0.00           O  
HETATM    2  C   UNL     1       4.979   4.431  -0.292  1.00  0.00           C  
HETATM    3  C   UNL     1       4.744   2.919  -0.298  1.00  0.00           C  
HETATM    4  N   UNL     1       3.311   2.647  -0.167  1.00  0.00           N  
HETATM    5  C   UNL     1       2.850   1.331  -0.147  1.00  0.00           C  
HETATM    6  C   UNL     1       3.760   0.278  -0.253  1.00  0.00           C  
HETATM    7  C   UNL     1       3.330  -1.017  -0.236  1.00  0.00           C  
HETATM    8  C   UNL     1       1.495   1.082  -0.018  1.00  0.00           C  
HETATM    9  C   UNL     1       1.036  -0.236   0.001  1.00  0.00           C  
HETATM   10  C   UNL     1       1.969  -1.294  -0.112  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.282  -0.526   0.126  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.720  -1.749   0.144  1.00  0.00           C  
HETATM   13  N   UNL     1       0.099  -2.831   0.042  1.00  0.00           N  
HETATM   14  N   UNL     1      -0.123  -4.215   0.037  1.00  0.00           N  
HETATM   15  C   UNL     1       1.452  -2.665  -0.087  1.00  0.00           C  
HETATM   16  N   UNL     1       2.001  -3.860  -0.161  1.00  0.00           N  
HETATM   17  C   UNL     1       1.051  -4.794  -0.091  1.00  0.00           C  
HETATM   18  N   UNL     1       1.269  -6.169  -0.139  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.202  -1.979   0.286  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.910  -0.652   0.382  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.352  -0.021  -0.766  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.002   1.199  -0.679  1.00  0.00           C  
HETATM   23  O   UNL     1      -4.528   2.014  -1.640  1.00  0.00           O  
HETATM   24  C   UNL     1      -4.695   3.296  -1.006  1.00  0.00           C  
HETATM   25  O   UNL     1      -4.866   2.970   0.386  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.211   1.786   0.566  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.766   1.148   1.712  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.121  -0.072   1.619  1.00  0.00           C  
HETATM   29  H   UNL     1       4.730   5.923   1.055  1.00  0.00           H  
HETATM   30  H   UNL     1       4.376   4.895  -1.072  1.00  0.00           H  
HETATM   31  H   UNL     1       6.034   4.636  -0.478  1.00  0.00           H  
HETATM   32  H   UNL     1       5.110   2.498  -1.234  1.00  0.00           H  
HETATM   33  H   UNL     1       5.278   2.466   0.538  1.00  0.00           H  
HETATM   34  H   UNL     1       2.682   3.383  -0.094  1.00  0.00           H  
HETATM   35  H   UNL     1       4.815   0.491  -0.349  1.00  0.00           H  
HETATM   36  H   UNL     1       0.797   1.902   0.068  1.00  0.00           H  
HETATM   37  H   UNL     1       4.042  -1.826  -0.318  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.569  -2.525  -0.583  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.395  -2.560   1.188  1.00  0.00           H  
HETATM   40  H   UNL     1       0.520  -6.782  -0.077  1.00  0.00           H  
HETATM   41  H   UNL     1       2.171  -6.514  -0.234  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.189  -0.479  -1.730  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.779  -0.570   2.514  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.807   3.913  -1.148  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.580   3.802  -1.392  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.925   1.601   2.679  1.00  0.00           H  
CONECT    1    2   29                                                 
CONECT    2    1    3   30   31                                       
CONECT    3    2    4   32   33                                       
CONECT    4    3    5   34                                            
CONECT    5    4    6    8    8                                       
CONECT    6    5    7    7   35                                       
CONECT    7    6    6   10   37                                       
CONECT    8    5    5    9   36                                       
CONECT    9    8   10   10   11                                       
CONECT   10    7    9    9   15                                       
CONECT   11    9   12   12                                            
CONECT   12   11   11   13   19                                       
CONECT   13   12   14   15                                            
CONECT   14   13   17   17                                            
CONECT   15   10   13   16   16                                       
CONECT   16   15   15   17                                            
CONECT   17   14   14   16   18                                       
CONECT   18   17   40   41                                            
CONECT   19   12   20   38   39                                       
CONECT   20   19   21   28   28                                       
CONECT   21   20   22   22   42                                       
CONECT   22   21   21   23   26                                       
CONECT   23   22   24                                                 
CONECT   24   23   25   44   45                                       
CONECT   25   24   26                                                 
CONECT   26   22   25   27   27                                       
CONECT   27   26   26   28   46                                       
CONECT   28   20   20   27   43                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    7                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   21                                                      
CONECT   43   28                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   27                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
