COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.324   3.104   0.292  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.108   3.104   0.251  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.338   4.201   0.344  1.00  0.00           N  
HETATM    4  C   UNL     1       0.069   3.792   0.254  1.00  0.00           C  
HETATM    5  C   UNL     1       0.061   2.292   0.092  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.274   1.902   0.101  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.597   0.533  -0.035  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.873  -0.200  -0.066  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.208   0.192   0.027  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.206  -0.756  -0.038  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.887  -2.097  -0.194  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.572  -2.499  -0.287  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.549  -1.557  -0.225  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.174  -1.669  -0.289  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.442  -2.928  -0.453  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.587  -0.420  -0.176  1.00  0.00           C  
HETATM   17  C   UNL     1       0.755  -0.014  -0.183  1.00  0.00           C  
HETATM   18  C   UNL     1       1.070   1.346  -0.043  1.00  0.00           C  
HETATM   19  C   UNL     1       2.542   1.438  -0.090  1.00  0.00           C  
HETATM   20  C   UNL     1       3.438   2.501  -0.007  1.00  0.00           C  
HETATM   21  C   UNL     1       4.794   2.261  -0.087  1.00  0.00           C  
HETATM   22  C   UNL     1       5.265   0.967  -0.250  1.00  0.00           C  
HETATM   23  C   UNL     1       4.389  -0.093  -0.335  1.00  0.00           C  
HETATM   24  C   UNL     1       3.017   0.129  -0.255  1.00  0.00           C  
HETATM   25  N   UNL     1       1.931  -0.726  -0.304  1.00  0.00           N  
HETATM   26  C   UNL     1       2.017  -2.179  -0.463  1.00  0.00           C  
HETATM   27  C   UNL     1       2.078  -2.841   0.915  1.00  0.00           C  
HETATM   28  C   UNL     1       2.023  -4.303   0.761  1.00  0.00           C  
HETATM   29  N   UNL     1       1.982  -5.432   0.641  1.00  0.00           N  
HETATM   30  H   UNL     1       0.536   4.260  -0.613  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.460   1.235   0.150  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.240  -0.454   0.034  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.676  -2.833  -0.243  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.335  -3.546  -0.408  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.111  -3.023  -1.487  1.00  0.00           H  
HETATM   36  H   UNL     1       0.424  -2.933   0.209  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.096  -3.763  -0.203  1.00  0.00           H  
HETATM   38  H   UNL     1       3.073   3.509   0.120  1.00  0.00           H  
HETATM   39  H   UNL     1       5.490   3.083  -0.022  1.00  0.00           H  
HETATM   40  H   UNL     1       6.328   0.789  -0.313  1.00  0.00           H  
HETATM   41  H   UNL     1       4.766  -1.097  -0.462  1.00  0.00           H  
HETATM   42  H   UNL     1       1.138  -2.539  -1.000  1.00  0.00           H  
HETATM   43  H   UNL     1       2.915  -2.431  -1.027  1.00  0.00           H  
HETATM   44  H   UNL     1       3.007  -2.562   1.411  1.00  0.00           H  
HETATM   45  H   UNL     1       1.231  -2.507   1.516  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.657   5.110   0.452  1.00  0.00           H  
HETATM   47  H   UNL     1       0.603   4.069   1.163  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    6    1    1                                       
CONECT    3    4    2   46                                            
CONECT    4    5    3   30   47                                       
CONECT    5   18    4    6    6                                       
CONECT    6    5    5    2    7                                       
CONECT    7   16   16    6    8                                       
CONECT    8    7   13   13    9                                       
CONECT    9    8   10   10   31                                       
CONECT   10    9    9   11   32                                       
CONECT   11   12   12   10   33                                       
CONECT   12   13   11   11   34                                       
CONECT   13   14    8    8   12                                       
CONECT   14   16   15   13                                            
CONECT   15   14   35   36   37                                       
CONECT   16   17    7    7   14                                       
CONECT   17   25   18   18   16                                       
CONECT   18   19   17   17    5                                       
CONECT   19   20   20   24   18                                       
CONECT   20   21   19   19   38                                       
CONECT   21   22   22   20   39                                       
CONECT   22   21   21   23   40                                       
CONECT   23   22   24   24   41                                       
CONECT   24   23   23   19   25                                       
CONECT   25   24   26   17                                            
CONECT   26   27   25   42   43                                       
CONECT   27   28   26   44   45                                       
CONECT   28   29   29   29   27                                       
CONECT   29   28   28   28                                            
CONECT   30    4                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   15                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   26                                                      
CONECT   43   26                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
CONECT   46    3                                                      
CONECT   47    4                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
