COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       4.110  -0.627  -0.095  1.00  0.00           O  
HETATM    2  C   UNL     1       3.734   0.527  -0.016  1.00  0.00           C  
HETATM    3  N   UNL     1       4.628   1.533  -0.084  1.00  0.00           N  
HETATM    4  C   UNL     1       6.053   1.237  -0.253  1.00  0.00           C  
HETATM    5  C   UNL     1       6.844   2.546  -0.300  1.00  0.00           C  
HETATM    6  N   UNL     1       2.422   0.800   0.133  1.00  0.00           N  
HETATM    7  C   UNL     1       1.486  -0.233   0.092  1.00  0.00           C  
HETATM    8  C   UNL     1       0.141   0.073   0.141  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.787  -0.976   0.097  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.181  -0.748   0.143  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.043  -1.831   0.097  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.550  -3.128   0.007  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.210  -3.373  -0.039  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.707  -4.790  -0.137  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.300  -2.306   0.005  1.00  0.00           C  
HETATM   16  C   UNL     1       1.088  -2.514  -0.038  1.00  0.00           C  
HETATM   17  N   UNL     1       1.910  -1.491   0.001  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.713   0.631   0.240  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.231   1.521   1.205  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.754   2.796   1.259  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.696   3.178   0.418  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.179   2.370  -0.507  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.255   2.865  -1.439  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.708   1.081  -0.636  1.00  0.00           C  
HETATM   25  H   UNL     1       4.328   2.454  -0.022  1.00  0.00           H  
HETATM   26  H   UNL     1       6.400   0.633   0.585  1.00  0.00           H  
HETATM   27  H   UNL     1       6.202   0.688  -1.183  1.00  0.00           H  
HETATM   28  H   UNL     1       7.904   2.325  -0.426  1.00  0.00           H  
HETATM   29  H   UNL     1       6.497   3.150  -1.138  1.00  0.00           H  
HETATM   30  H   UNL     1       6.694   3.094   0.630  1.00  0.00           H  
HETATM   31  H   UNL     1       2.130   1.714   0.270  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.189   1.099   0.211  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.110  -1.666   0.132  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.242  -3.956  -0.028  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.562  -5.194   0.865  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.436  -5.399  -0.673  1.00  0.00           H  
HETATM   37  H   UNL     1       0.242  -4.802  -0.675  1.00  0.00           H  
HETATM   38  H   UNL     1       1.480  -3.517  -0.113  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.460   1.215   1.897  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.389   3.491   2.001  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.794   3.309  -2.322  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.888   2.031  -1.739  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.860   3.615  -0.929  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.104   0.426  -1.398  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    6    3    1    1                                       
CONECT    3    2    4   25                                            
CONECT    4    5    3   26   27                                       
CONECT    5    4   28   29   30                                       
CONECT    6    7    2   31                                            
CONECT    7   17    6    8    8                                       
CONECT    8    7    7    9   32                                       
CONECT    9   15    8   10   10                                       
CONECT   10    9    9   11   18                                       
CONECT   11   12   12   10   33                                       
CONECT   12   13   11   11   34                                       
CONECT   13   14   15   15   12                                       
CONECT   14   13   35   36   37                                       
CONECT   15   16   13   13    9                                       
CONECT   16   17   17   15   38                                       
CONECT   17   16   16    7                                            
CONECT   18   10   19   19   24                                       
CONECT   19   18   18   20   39                                       
CONECT   20   19   21   21   40                                       
CONECT   21   20   20   22                                            
CONECT   22   24   24   21   23                                       
CONECT   23   22   41   42   43                                       
CONECT   24   18   22   22   44                                       
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    8                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
