COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.299   0.495   0.009  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.773   0.625   0.022  1.00  0.00           N1+
HETATM    3  O   UNL     1      -6.287   1.729   0.049  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.721  -0.756  -0.027  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.471  -3.321   0.019  1.00  0.00           N  
HETATM    6  O   UNL     1      -6.473  -0.372   0.006  1.00  0.00           O1-
HETATM    7  C   UNL     1      -2.330  -0.881  -0.040  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.146   0.162  -0.029  1.00  0.00           N  
HETATM    9  O   UNL     1      -0.500  -2.320  -0.197  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.530   0.272  -0.016  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.131   1.524   0.020  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.507   1.631   0.027  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.706  -2.216  -0.078  1.00  0.00           C  
HETATM   14  C   UNL     1       0.686   1.359   0.119  1.00  0.00           C  
HETATM   15  C   UNL     1       2.141   0.969   0.071  1.00  0.00           C  
HETATM   16  C   UNL     1       2.806   0.938  -1.142  1.00  0.00           C  
HETATM   17  C   UNL     1       4.138   0.581  -1.192  1.00  0.00           C  
HETATM   18  C   UNL     1       4.814   0.252  -0.016  1.00  0.00           C  
HETATM   19  C   UNL     1       4.137   0.286   1.204  1.00  0.00           C  
HETATM   20  C   UNL     1       2.806   0.650   1.241  1.00  0.00           C  
HETATM   21  C   UNL     1       6.240  -0.130  -0.063  1.00  0.00           C  
HETATM   22  O   UNL     1       6.890  -0.447   1.074  1.00  0.00           O  
HETATM   23  O   UNL     1       6.827  -0.159  -1.126  1.00  0.00           O  
HETATM   24  H   UNL     1      -4.344  -1.638  -0.045  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.061  -4.200  -0.006  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.433  -3.238   0.114  1.00  0.00           H  
HETATM   27  H   UNL     1       0.270  -0.708  -0.136  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.520   2.415   0.039  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.969   2.607   0.051  1.00  0.00           H  
HETATM   30  H   UNL     1       0.469   2.054  -0.692  1.00  0.00           H  
HETATM   31  H   UNL     1       0.468   1.837   1.074  1.00  0.00           H  
HETATM   32  H   UNL     1       2.281   1.192  -2.051  1.00  0.00           H  
HETATM   33  H   UNL     1       4.656   0.557  -2.140  1.00  0.00           H  
HETATM   34  H   UNL     1       4.654   0.033   2.118  1.00  0.00           H  
HETATM   35  H   UNL     1       2.282   0.680   2.185  1.00  0.00           H  
HETATM   36  H   UNL     1       7.822  -0.692   0.993  1.00  0.00           H  
CONECT    1    2   12   12    4                                       
CONECT    2    1    3    3    6                                       
CONECT    3    2    2                                                 
CONECT    4    1   24    7    7                                       
CONECT    5   13   25   26                                            
CONECT    6    2                                                      
CONECT    7    4    4   10   13                                       
CONECT    8   10   14   27                                            
CONECT    9   13   13                                                 
CONECT   10    7    8   11   11                                       
CONECT   11   10   10   12   28                                       
CONECT   12    1    1   11   29                                       
CONECT   13    5    9    9    7                                       
CONECT   14    8   15   30   31                                       
CONECT   15   14   16   20   20                                       
CONECT   16   15   17   17   32                                       
CONECT   17   16   16   33   18                                       
CONECT   18   17   21   19   19                                       
CONECT   19   18   18   34   20                                       
CONECT   20   15   15   19   35                                       
CONECT   21   18   22   23   23                                       
CONECT   22   21   36                                                 
CONECT   23   21   21                                                 
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    8                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   14                                                      
CONECT   31   14                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   22                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
