COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.040  -0.118   1.213  1.00  0.00           N1+
HETATM    2  N   UNL     1      -3.995  -2.713  -1.205  1.00  0.00           N  
HETATM    3  C   UNL     1       0.935   0.612   0.587  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.056   1.186   1.292  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.163  -1.000   1.540  1.00  0.00           C  
HETATM    6  C   UNL     1       2.322   0.502   0.115  1.00  0.00           C  
HETATM    7  C   UNL     1       0.732  -1.862   0.510  1.00  0.00           C  
HETATM    8  C   UNL     1       2.904  -0.831  -0.160  1.00  0.00           C  
HETATM    9  C   UNL     1       2.127  -1.986   0.033  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.235   2.014   1.735  1.00  0.00           C  
HETATM   11  C   UNL     1       0.197   3.665  -0.507  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.000  -1.226   0.308  1.00  0.00           C  
HETATM   13  C   UNL     1       2.675  -3.237  -0.225  1.00  0.00           C  
HETATM   14  C   UNL     1       4.747  -2.203  -0.860  1.00  0.00           C  
HETATM   15  C   UNL     1       3.983  -3.338  -0.670  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.261  -2.514  -0.125  1.00  0.00           C  
HETATM   17  C   UNL     1       0.164  -0.524   0.780  1.00  0.00           C  
HETATM   18  C   UNL     1       0.523   3.092   0.873  1.00  0.00           C  
HETATM   19  C   UNL     1       4.215  -0.949  -0.608  1.00  0.00           C  
HETATM   20  C   UNL     1       0.306   5.678  -1.804  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.219  -0.392  -1.441  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.480  -1.680  -1.873  1.00  0.00           C  
HETATM   23  N   UNL     1       0.141   1.678   0.918  1.00  0.00           N  
HETATM   24  N   UNL     1      -3.485  -0.194  -0.360  1.00  0.00           N  
HETATM   25  O   UNL     1       2.989   1.505  -0.051  1.00  0.00           O  
HETATM   26  O   UNL     1       0.055  -2.856   0.679  1.00  0.00           O  
HETATM   27  O   UNL     1       0.570   5.043  -0.551  1.00  0.00           O  
HETATM   28  H   UNL     1      -1.782  -1.955   1.901  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.775  -0.537   2.315  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.193   2.159   2.814  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.205   2.983   1.237  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.159   1.499   1.473  1.00  0.00           H  
HETATM   33  H   UNL     1       0.750   3.115  -1.269  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.872   3.571  -0.697  1.00  0.00           H  
HETATM   35  H   UNL     1       2.083  -4.128  -0.078  1.00  0.00           H  
HETATM   36  H   UNL     1       5.766  -2.293  -1.207  1.00  0.00           H  
HETATM   37  H   UNL     1       4.408  -4.311  -0.870  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.865  -3.358   0.421  1.00  0.00           H  
HETATM   39  H   UNL     1       1.592   3.185   1.062  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.030   3.642   1.635  1.00  0.00           H  
HETATM   41  H   UNL     1       4.817  -0.065  -0.758  1.00  0.00           H  
HETATM   42  H   UNL     1       0.617   6.721  -1.756  1.00  0.00           H  
HETATM   43  H   UNL     1       0.862   5.169  -2.592  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.761   5.626  -2.020  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.616   0.451  -1.987  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.080  -1.842  -2.756  1.00  0.00           H  
CONECT    1    4    4   17    5                                       
CONECT    2   16   16   22                                            
CONECT    3    6   23   17   17                                       
CONECT    4   23   10    1    1                                       
CONECT    5    1   12   28   29                                       
CONECT    6   25   25    8    3                                       
CONECT    7    9   17   26   26                                       
CONECT    8   19    6    9    9                                       
CONECT    9    8    8   13    7                                       
CONECT   10    4   30   31   32                                       
CONECT   11   18   27   33   34                                       
CONECT   12    5   24   24   16                                       
CONECT   13   15   15    9   35                                       
CONECT   14   19   19   15   36                                       
CONECT   15   14   13   13   37                                       
CONECT   16   12    2    2   38                                       
CONECT   17    3    3    7    1                                       
CONECT   18   11   23   39   40                                       
CONECT   19   14   14    8   41                                       
CONECT   20   27   42   43   44                                       
CONECT   21   24   22   22   45                                       
CONECT   22   21   21    2   46                                       
CONECT   23   18    3    4                                            
CONECT   24   12   12   21                                            
CONECT   25    6    6                                                 
CONECT   26    7    7                                                 
CONECT   27   11   20                                                 
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
