COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.608   3.443   0.084  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.132   1.126  -0.040  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.772   0.865   0.002  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.350  -0.470  -0.038  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.307  -1.480  -0.119  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.026   0.059  -0.120  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.589   2.406   0.003  1.00  0.00           O  
HETATM    8  N   UNL     1      -5.592  -1.190  -0.156  1.00  0.00           N  
HETATM    9  O   UNL     1      -7.360   0.305  -0.161  1.00  0.00           O  
HETATM   10  C   UNL     1      -8.227  -0.828  -0.243  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.908  -0.803   0.003  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.508  -2.139  -0.038  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.162  -2.443   0.000  1.00  0.00           C  
HETATM   14  C   UNL     1       0.756  -1.388   0.079  1.00  0.00           C  
HETATM   15  C   UNL     1       0.278  -0.075   0.117  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.010   0.175   0.073  1.00  0.00           N  
HETATM   17  C   UNL     1       1.495   0.815   0.201  1.00  0.00           C  
HETATM   18  N   UNL     1       2.658  -0.079   0.208  1.00  0.00           N  
HETATM   19  C   UNL     1       2.227  -1.350   0.137  1.00  0.00           C  
HETATM   20  O   UNL     1       2.948  -2.329   0.124  1.00  0.00           O  
HETATM   21  C   UNL     1       4.003   0.327   0.277  1.00  0.00           C  
HETATM   22  C   UNL     1       4.464   1.649   0.357  1.00  0.00           C  
HETATM   23  N   UNL     1       5.771   1.628   0.404  1.00  0.00           N  
HETATM   24  N   UNL     1       6.193   0.293   0.356  1.00  0.00           N  
HETATM   25  C   UNL     1       5.087  -0.492   0.284  1.00  0.00           C  
HETATM   26  C   UNL     1       7.581  -0.175   0.384  1.00  0.00           C  
HETATM   27  C   UNL     1       8.340   0.477  -0.695  1.00  0.00           C  
HETATM   28  N   UNL     1       8.927   0.979  -1.528  1.00  0.00           N  
HETATM   29  H   UNL     1      -4.017   3.313   0.991  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.954   3.394  -0.786  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.106   4.412   0.111  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.055   1.670   0.064  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.991  -2.512  -0.150  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.263  -0.492  -0.269  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.004  -1.391  -1.150  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.073  -1.467   0.627  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.244  -2.928  -0.100  1.00  0.00           H  
HETATM   38  H   UNL     1       0.175  -3.469  -0.030  1.00  0.00           H  
HETATM   39  H   UNL     1       1.536   1.476  -0.664  1.00  0.00           H  
HETATM   40  H   UNL     1       1.468   1.401   1.120  1.00  0.00           H  
HETATM   41  H   UNL     1       3.845   2.534   0.376  1.00  0.00           H  
HETATM   42  H   UNL     1       5.071  -1.571   0.237  1.00  0.00           H  
HETATM   43  H   UNL     1       8.029   0.076   1.346  1.00  0.00           H  
HETATM   44  H   UNL     1       7.603  -1.255   0.244  1.00  0.00           H  
CONECT    1    7   29   30   31                                       
CONECT    2    7    6    6    3                                       
CONECT    3    2    4    4   32                                       
CONECT    4    3    3    5   11                                       
CONECT    5    8    8    4   33                                       
CONECT    6    9    2    2    8                                       
CONECT    7    1    2                                                 
CONECT    8    6    5    5                                            
CONECT    9   10    6                                                 
CONECT   10    9   34   35   36                                       
CONECT   11    4   16   12   12                                       
CONECT   12   11   11   13   37                                       
CONECT   13   12   14   14   38                                       
CONECT   14   15   19   13   13                                       
CONECT   15   16   16   17   14                                       
CONECT   16   15   15   11                                            
CONECT   17   15   18   39   40                                       
CONECT   18   17   21   19                                            
CONECT   19   18   14   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   22   18   25   25                                       
CONECT   22   23   23   21   41                                       
CONECT   23   22   22   24                                            
CONECT   24   23   25   26                                            
CONECT   25   21   21   24   42                                       
CONECT   26   27   24   43   44                                       
CONECT   27   28   28   28   26                                       
CONECT   28   27   27   27                                            
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   22                                                      
CONECT   42   25                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
