COMPND    HMDB0240364
HETATM    1  N1  UNL     1       1.948  -0.065  -1.495  1.00  0.00           N  
HETATM    2  C1  UNL     1       2.260   0.142  -0.269  1.00  0.00           C  
HETATM    3  N2  UNL     1       3.619   0.301   0.074  1.00  0.00           N  
HETATM    4  N3  UNL     1       1.235   0.203   0.700  1.00  0.00           N  
HETATM    5  C2  UNL     1      -0.127  -0.086   0.421  1.00  0.00           C  
HETATM    6  C3  UNL     1      -0.561  -1.386   0.568  1.00  0.00           C  
HETATM    7 CL1  UNL     1       0.572  -2.621   1.090  1.00  0.00          CL  
HETATM    8  C4  UNL     1      -1.881  -1.664   0.297  1.00  0.00           C  
HETATM    9  C5  UNL     1      -2.747  -0.670  -0.111  1.00  0.00           C  
HETATM   10  C6  UNL     1      -2.306   0.656  -0.262  1.00  0.00           C  
HETATM   11  N4  UNL     1      -3.074   1.668  -0.650  1.00  0.00           N  
HETATM   12  S1  UNL     1      -2.042   2.988  -0.654  1.00  0.00           S  
HETATM   13  N5  UNL     1      -0.640   2.214  -0.156  1.00  0.00           N  
HETATM   14  C7  UNL     1      -1.006   0.937   0.004  1.00  0.00           C  
HETATM   15  H1  UNL     1       0.967  -0.193  -1.830  1.00  0.00           H  
HETATM   16  H2  UNL     1       4.400  -0.004  -0.535  1.00  0.00           H  
HETATM   17  H3  UNL     1       3.907   0.750   0.989  1.00  0.00           H  
HETATM   18  H4  UNL     1       1.443   0.475   1.705  1.00  0.00           H  
HETATM   19  H5  UNL     1      -2.200  -2.686   0.419  1.00  0.00           H  
HETATM   20  H6  UNL     1      -3.768  -0.958  -0.307  1.00  0.00           H  
CONECT    1    2    2   15
CONECT    2    3    4
CONECT    3   16   17
CONECT    4    5   18
CONECT    5    6    6   14
CONECT    6    7    8
CONECT    8    9    9   19
CONECT    9   10   20
CONECT   10   11   11   14
CONECT   11   12
CONECT   12   13
CONECT   13   14   14
END