COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.474  -2.238  -0.244  1.00  0.00           O  
HETATM    2  N   UNL     1      -4.647  -1.167   0.309  1.00  0.00           N1+
HETATM    3  O   UNL     1      -5.628  -0.996   1.010  1.00  0.00           O1-
HETATM    4  C   UNL     1      -3.662  -0.076   0.134  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.857   1.137   0.768  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.940   2.158   0.606  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.821   1.963  -0.192  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.917   2.965  -0.352  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.181   4.192   0.331  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.546  -0.274  -0.657  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.628   0.744  -0.826  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.414   0.530  -1.693  1.00  0.00           C  
HETATM   13  N   UNL     1       0.716   0.116  -0.858  1.00  0.00           N  
HETATM   14  C   UNL     1       0.982  -1.179  -0.473  1.00  0.00           C  
HETATM   15  C   UNL     1       0.352  -2.397  -0.708  1.00  0.00           C  
HETATM   16  C   UNL     1       0.875  -3.552  -0.169  1.00  0.00           C  
HETATM   17  C   UNL     1       2.148  -1.146   0.314  1.00  0.00           C  
HETATM   18  C   UNL     1       2.660  -2.329   0.850  1.00  0.00           C  
HETATM   19  C   UNL     1       2.025  -3.515   0.607  1.00  0.00           C  
HETATM   20  C   UNL     1       2.558   0.259   0.371  1.00  0.00           C  
HETATM   21  C   UNL     1       1.668   0.957  -0.351  1.00  0.00           C  
HETATM   22  C   UNL     1       3.756   0.814   1.097  1.00  0.00           C  
HETATM   23  C   UNL     1       4.974   0.701   0.217  1.00  0.00           C  
HETATM   24  O   UNL     1       6.165   1.136   0.659  1.00  0.00           O  
HETATM   25  O   UNL     1       4.879   0.220  -0.887  1.00  0.00           O  
HETATM   26  H   UNL     1      -4.728   1.288   1.388  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.093   3.105   1.100  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.133   4.600  -0.009  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.227   4.008   1.405  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.384   4.905   0.119  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.394  -1.224  -1.147  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.626  -0.246  -2.429  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.166   1.459  -2.206  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.543  -2.436  -1.310  1.00  0.00           H  
HETATM   35  H   UNL     1       0.385  -4.497  -0.353  1.00  0.00           H  
HETATM   36  H   UNL     1       3.554  -2.307   1.455  1.00  0.00           H  
HETATM   37  H   UNL     1       2.422  -4.430   1.021  1.00  0.00           H  
HETATM   38  H   UNL     1       1.697   2.026  -0.506  1.00  0.00           H  
HETATM   39  H   UNL     1       3.580   1.862   1.341  1.00  0.00           H  
HETATM   40  H   UNL     1       3.918   0.250   2.016  1.00  0.00           H  
HETATM   41  H   UNL     1       6.917   1.043   0.059  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2                                                      
CONECT    4    2    5    5   10                                       
CONECT    5    4    4    6   26                                       
CONECT    6    5    7    7   27                                       
CONECT    7    6    6   11    8                                       
CONECT    8    7    9                                                 
CONECT    9    8   28   29   30                                       
CONECT   10    4   11   11   31                                       
CONECT   11   10   10    7   12                                       
CONECT   12   11   13   32   33                                       
CONECT   13   12   21   14                                            
CONECT   14   13   15   15   17                                       
CONECT   15   14   14   16   34                                       
CONECT   16   15   19   19   35                                       
CONECT   17   14   20   18   18                                       
CONECT   18   17   17   19   36                                       
CONECT   19   16   16   18   37                                       
CONECT   20   21   21   17   22                                       
CONECT   21   13   20   20   38                                       
CONECT   22   20   23   39   40                                       
CONECT   23   22   25   25   24                                       
CONECT   24   23   41                                                 
CONECT   25   23   23                                                 
CONECT   26    5                                                      
CONECT   27    6                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   22                                                      
CONECT   41   24                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
