COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.665   0.264  -0.075  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.040   1.563   0.238  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.411  -1.866  -0.794  1.00  0.00           C  
HETATM    4  C   UNL     1       2.439  -0.393   0.418  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.086   2.560   0.315  1.00  0.00           C  
HETATM    6  C   UNL     1       3.912  -0.635   0.221  1.00  0.00           C  
HETATM    7  C   UNL     1       2.809   1.873  -0.315  1.00  0.00           C  
HETATM    8  C   UNL     1       0.243   2.268   0.081  1.00  0.00           C  
HETATM    9  C   UNL     1       4.724   0.289  -0.402  1.00  0.00           C  
HETATM   10  C   UNL     1       4.179   1.591  -0.932  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.646  -2.295   1.617  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.678  -2.282  -1.496  1.00  0.00           C  
HETATM   13  C   UNL     1       4.454  -1.825   0.683  1.00  0.00           C  
HETATM   14  C   UNL     1       6.077   0.026  -0.557  1.00  0.00           C  
HETATM   15  C   UNL     1       5.800  -2.087   0.526  1.00  0.00           C  
HETATM   16  C   UNL     1       6.614  -1.158  -0.095  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.633  -0.747  -0.154  1.00  0.00           N  
HETATM   18  N   UNL     1      -3.464   1.881   0.490  1.00  0.00           N1+
HETATM   19  N   UNL     1      -3.743  -0.761  -1.008  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.656  -1.885   0.576  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.331  -0.033  -0.317  1.00  0.00           C  
HETATM   22  N   UNL     1       1.970   0.674  -0.471  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.749  -2.591   0.203  1.00  0.00           C  
HETATM   24  C   UNL     1       0.626   0.969  -0.233  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.809   3.037   0.656  1.00  0.00           O1-
HETATM   26  O   UNL     1      -4.289   0.987   0.532  1.00  0.00           O  
HETATM   27  H   UNL     1       1.891  -1.310   0.201  1.00  0.00           H  
HETATM   28  H   UNL     1       2.257  -0.105   1.454  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.381   3.570   0.559  1.00  0.00           H  
HETATM   30  H   UNL     1       2.924   2.103   0.745  1.00  0.00           H  
HETATM   31  H   UNL     1       2.345   2.717  -0.824  1.00  0.00           H  
HETATM   32  H   UNL     1       0.987   3.049   0.142  1.00  0.00           H  
HETATM   33  H   UNL     1       4.082   1.528  -2.015  1.00  0.00           H  
HETATM   34  H   UNL     1       4.864   2.400  -0.678  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.955  -1.916   2.591  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.582  -3.382   1.653  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.671  -1.882   1.359  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.539  -1.902  -0.946  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.684  -1.875  -2.507  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.727  -3.370  -1.541  1.00  0.00           H  
HETATM   41  H   UNL     1       3.819  -2.551   1.169  1.00  0.00           H  
HETATM   42  H   UNL     1       6.713   0.752  -1.042  1.00  0.00           H  
HETATM   43  H   UNL     1       6.217  -3.015   0.889  1.00  0.00           H  
HETATM   44  H   UNL     1       7.668  -1.358  -0.218  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.038  -1.042  -0.566  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.056  -3.546   0.604  1.00  0.00           H  
CONECT    1    2    2   17   21                                       
CONECT    2   18    5    1    1                                       
CONECT    3   19   19   12   23                                       
CONECT    4   22    6   27   28                                       
CONECT    5    2    8    8   29                                       
CONECT    6   13    4    9    9                                       
CONECT    7   22   10   30   31                                       
CONECT    8    5    5   24   32                                       
CONECT    9    6    6   14   10                                       
CONECT   10    9    7   33   34                                       
CONECT   11   20   35   36   37                                       
CONECT   12    3   38   39   40                                       
CONECT   13   15   15    6   41                                       
CONECT   14   16   16    9   42                                       
CONECT   15   13   13   16   43                                       
CONECT   16   15   14   14   44                                       
CONECT   17    1   19   20                                            
CONECT   18   25   26   26    2                                       
CONECT   19   17    3    3                                            
CONECT   20   17   23   23   11                                       
CONECT   21    1   24   24   45                                       
CONECT   22   24    4    7                                            
CONECT   23    3   20   20   46                                       
CONECT   24    8   21   21   22                                       
CONECT   25   18                                                      
CONECT   26   18   18                                                 
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
