COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.345   0.020   0.032  1.00  0.00           N  
HETATM    2  N   UNL     1       2.984  -4.119   0.037  1.00  0.00           N  
HETATM    3  N   UNL     1       5.202   3.169   1.204  1.00  0.00           N  
HETATM    4  N   UNL     1      -2.417  -0.664   0.073  1.00  0.00           N  
HETATM    5  N   UNL     1      -2.101  -3.469  -0.015  1.00  0.00           N1+
HETATM    6  C   UNL     1       0.331  -3.079  -0.027  1.00  0.00           C  
HETATM    7  C   UNL     1       1.440  -2.228  -0.018  1.00  0.00           C  
HETATM    8  C   UNL     1       1.250  -0.835   0.023  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.036  -0.320   0.052  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.126  -1.181   0.043  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.931  -2.561   0.002  1.00  0.00           C  
HETATM   12  C   UNL     1       2.801  -2.787  -0.049  1.00  0.00           C  
HETATM   13  C   UNL     1       2.145   1.467  -0.072  1.00  0.00           C  
HETATM   14  C   UNL     1       3.482   2.162  -0.038  1.00  0.00           C  
HETATM   15  C   UNL     1       4.032   2.561   1.166  1.00  0.00           C  
HETATM   16  C   UNL     1       5.889   3.421   0.107  1.00  0.00           C  
HETATM   17  C   UNL     1       5.401   3.052  -1.133  1.00  0.00           C  
HETATM   18  C   UNL     1       4.175   2.410  -1.213  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.629   0.782  -0.016  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.129   1.082   0.040  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.350   2.593  -0.052  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.827   2.889   0.002  1.00  0.00           C  
HETATM   23  O   UNL     1       3.760  -2.046  -0.153  1.00  0.00           O  
HETATM   24  O   UNL     1      -6.261   4.157  -0.063  1.00  0.00           O  
HETATM   25  O   UNL     1      -6.621   1.984   0.104  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.102  -3.160  -0.636  1.00  0.00           O1-
HETATM   27  O   UNL     1      -2.061  -4.524   0.592  1.00  0.00           O  
HETATM   28  H   UNL     1       3.241  -0.342   0.112  1.00  0.00           H  
HETATM   29  H   UNL     1       2.219  -4.710   0.119  1.00  0.00           H  
HETATM   30  H   UNL     1       3.881  -4.488   0.016  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.177  -1.262   0.152  1.00  0.00           H  
HETATM   32  H   UNL     1       0.473  -4.149  -0.063  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.191   0.748   0.083  1.00  0.00           H  
HETATM   34  H   UNL     1       1.640   1.697  -1.010  1.00  0.00           H  
HETATM   35  H   UNL     1       1.535   1.811   0.763  1.00  0.00           H  
HETATM   36  H   UNL     1       3.499   2.371   2.086  1.00  0.00           H  
HETATM   37  H   UNL     1       6.843   3.921   0.177  1.00  0.00           H  
HETATM   38  H   UNL     1       5.968   3.261  -2.028  1.00  0.00           H  
HETATM   39  H   UNL     1       3.769   2.110  -2.168  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.129   1.275   0.818  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.219   1.153  -0.955  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.629   0.590  -0.794  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.539   0.711   0.979  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.850   3.085   0.782  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.940   2.964  -0.992  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.217   4.297  -0.024  1.00  0.00           H  
CONECT    1    8   13   28                                            
CONECT    2   12   29   30                                            
CONECT    3   16   16   15                                            
CONECT    4   19   31   10                                            
CONECT    5   27   27   11   26                                       
CONECT    6   11   32    7    7                                       
CONECT    7    6    6    8   12                                       
CONECT    8    1    7    9    9                                       
CONECT    9    8    8   10   33                                       
CONECT   10    9    4   11   11                                       
CONECT   11    6    5   10   10                                       
CONECT   12    2    7   23   23                                       
CONECT   13    1   14   34   35                                       
CONECT   14   13   18   15   15                                       
CONECT   15   14   14    3   36                                       
CONECT   16    3    3   17   37                                       
CONECT   17   16   38   18   18                                       
CONECT   18   14   17   17   39                                       
CONECT   19    4   20   40   41                                       
CONECT   20   19   21   42   43                                       
CONECT   21   20   22   44   45                                       
CONECT   22   21   25   25   24                                       
CONECT   23   12   12                                                 
CONECT   24   22   46                                                 
CONECT   25   22   22                                                 
CONECT   26    5                                                      
CONECT   27    5    5                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
