COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.774   2.905  -0.744  1.00  0.00           O  
HETATM    2  C   UNL     1       6.442   2.518  -0.399  1.00  0.00           C  
HETATM    3  C   UNL     1       6.401   1.011  -0.134  1.00  0.00           C  
HETATM    4  N   UNL     1       5.036   0.615   0.220  1.00  0.00           N  
HETATM    5  C   UNL     1       4.308  -0.340  -0.391  1.00  0.00           C  
HETATM    6  N   UNL     1       4.266   1.158   1.255  1.00  0.00           N  
HETATM    7  C   UNL     1       3.106   0.558   1.270  1.00  0.00           C  
HETATM    8  C   UNL     1       3.096  -0.401   0.237  1.00  0.00           C  
HETATM    9  C   UNL     1       1.977  -1.312  -0.103  1.00  0.00           C  
HETATM   10  N   UNL     1       0.816  -1.198   0.527  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.182  -2.014   0.220  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.470  -2.152   0.674  1.00  0.00           N  
HETATM   13  N   UNL     1      -2.038  -3.210  -0.052  1.00  0.00           N  
HETATM   14  N   UNL     1      -1.171  -3.677  -0.878  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.011  -2.998  -0.773  1.00  0.00           C  
HETATM   16  N   UNL     1       1.163  -3.103  -1.401  1.00  0.00           N  
HETATM   17  C   UNL     1       2.147  -2.287  -1.094  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.124  -1.352   1.713  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.795  -0.160   1.082  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.086  -0.259   0.663  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.712   0.851   0.074  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.046   0.789  -0.372  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.590   1.909  -0.934  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.826   3.069  -1.052  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.584   3.122  -0.636  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.993   2.062  -0.076  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.661   2.126   0.369  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.087   1.032   0.940  1.00  0.00           C  
HETATM   29  H   UNL     1       7.874   3.849  -0.926  1.00  0.00           H  
HETATM   30  H   UNL     1       6.129   3.053   0.498  1.00  0.00           H  
HETATM   31  H   UNL     1       5.768   2.761  -1.221  1.00  0.00           H  
HETATM   32  H   UNL     1       6.714   0.476  -1.031  1.00  0.00           H  
HETATM   33  H   UNL     1       7.075   0.768   0.688  1.00  0.00           H  
HETATM   34  H   UNL     1       4.624  -0.946  -1.227  1.00  0.00           H  
HETATM   35  H   UNL     1       2.296   0.759   1.956  1.00  0.00           H  
HETATM   36  H   UNL     1       3.093  -2.372  -1.607  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.870  -1.961   2.225  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.378  -1.012   2.432  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.626  -1.187   0.781  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.065   1.087   1.285  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.623  -0.118  -0.273  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.610   1.895  -1.287  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.270   3.946  -1.498  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.097   3.040   0.262  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    6                                            
CONECT    5    4    8    8   34                                       
CONECT    6    4    7    7                                            
CONECT    7    6    6    8   35                                       
CONECT    8    5    5    7    9                                       
CONECT    9    8   10   10   17                                       
CONECT   10    9    9   11                                            
CONECT   11   10   12   15   15                                       
CONECT   12   11   13   18                                            
CONECT   13   12   14   14                                            
CONECT   14   13   13   15                                            
CONECT   15   11   11   14   16                                       
CONECT   16   15   17   17                                            
CONECT   17    9   16   16   36                                       
CONECT   18   12   19   37   38                                       
CONECT   19   18   20   28   28                                       
CONECT   20   19   21   21   39                                       
CONECT   21   20   20   22   26                                       
CONECT   22   21   23   23   41                                       
CONECT   23   22   22   24   42                                       
CONECT   24   23   25   25   43                                       
CONECT   25   24   24   26                                            
CONECT   26   21   25   27   27                                       
CONECT   27   26   26   28   44                                       
CONECT   28   19   19   27   40                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    7                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   20                                                      
CONECT   40   28                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
