COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.986  -2.152  -1.289  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.043   3.669   0.868  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.890   4.245   1.373  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.688   1.267  -1.556  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.780   2.340  -0.502  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.627   2.919  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       2.970   1.331   0.067  1.00  0.00           C  
HETATM    8  C   UNL     1       4.302   2.021  -0.242  1.00  0.00           C  
HETATM    9  C   UNL     1       5.394  -0.106  -0.377  1.00  0.00           C  
HETATM   10  C   UNL     1       4.074  -0.818  -0.069  1.00  0.00           C  
HETATM   11  O   UNL     1       5.377   1.196   0.214  1.00  0.00           O  
HETATM   12  N   UNL     1       2.956   0.001  -0.560  1.00  0.00           N  
HETATM   13  N   UNL     1       1.619  -4.338   1.451  1.00  0.00           N1-
HETATM   14  C   UNL     1       0.520  -3.770   1.084  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.708   3.856   0.927  1.00  0.00           N  
HETATM   16  N   UNL     1      -2.962   2.728  -0.056  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.064  -2.911  -0.488  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.220  -2.169   0.851  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.230  -0.986   0.817  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.004  -0.723  -0.692  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.722  -0.050  -0.916  1.00  0.00           N  
HETATM   22  N   UNL     1       0.616  -0.048  -0.726  1.00  0.00           N  
HETATM   23  C   UNL     1      -0.547  -0.658  -0.523  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.578  -1.853   0.058  1.00  0.00           N  
HETATM   25  C   UNL     1       0.554  -2.438   0.436  1.00  0.00           C  
HETATM   26  N   UNL     1       1.717  -1.828   0.232  1.00  0.00           N  
HETATM   27  C   UNL     1       1.748  -0.632  -0.349  1.00  0.00           C  
HETATM   28  H   UNL     1      -2.009  -2.613  -1.146  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.244  -2.128  -2.348  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.008   3.986   1.234  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.955   5.011   2.131  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.529   1.359  -2.243  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.754   1.379  -2.108  1.00  0.00           H  
HETATM   34  H   UNL     1       0.338   2.601  -0.366  1.00  0.00           H  
HETATM   35  H   UNL     1       2.856   1.226   1.145  1.00  0.00           H  
HETATM   36  H   UNL     1       2.150   1.929  -0.330  1.00  0.00           H  
HETATM   37  H   UNL     1       4.391   2.174  -1.318  1.00  0.00           H  
HETATM   38  H   UNL     1       4.339   2.984   0.267  1.00  0.00           H  
HETATM   39  H   UNL     1       6.222  -0.683   0.036  1.00  0.00           H  
HETATM   40  H   UNL     1       5.517  -0.015  -1.456  1.00  0.00           H  
HETATM   41  H   UNL     1       4.059  -1.788  -0.565  1.00  0.00           H  
HETATM   42  H   UNL     1       3.977  -0.957   1.008  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.425  -4.266   1.249  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.009  -2.901  -1.032  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.745  -3.938  -0.313  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.240  -1.800   0.958  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.976  -2.837   1.678  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.667  -0.110   1.296  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.293  -1.259   1.301  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.824  -0.137  -1.109  1.00  0.00           H  
CONECT    1   20   17   28   29                                       
CONECT    2   16   16    3   30                                       
CONECT    3   15   15    2   31                                       
CONECT    4   21    5   32   33                                       
CONECT    5    4    6    6   16                                       
CONECT    6    5    5   15   34                                       
CONECT    7   12    8   35   36                                       
CONECT    8   11    7   37   38                                       
CONECT    9   10   11   39   40                                       
CONECT   10    9   12   41   42                                       
CONECT   11    9    8                                                 
CONECT   12   10   27    7                                            
CONECT   13   14   14                                                 
CONECT   14   13   13   25   43                                       
CONECT   15    6    3    3                                            
CONECT   16    5    2    2                                            
CONECT   17   18    1   44   45                                       
CONECT   18   19   17   46   47                                       
CONECT   19   20   18   48   49                                       
CONECT   20   19   21    1   50                                       
CONECT   21   23   20    4                                            
CONECT   22   27   27   23                                            
CONECT   23   24   24   22   21                                       
CONECT   24   25   23   23                                            
CONECT   25   14   26   26   24                                       
CONECT   26   25   25   27                                            
CONECT   27   26   12   22   22                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   14                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
