COMPND    HMDB0014868
HETATM    1  C1  UNL     1      -3.508   0.685  -0.576  1.00  0.00           C  
HETATM    2  C2  UNL     1      -3.545  -0.222   0.463  1.00  0.00           C  
HETATM    3  C3  UNL     1      -2.402  -0.726   1.030  1.00  0.00           C  
HETATM    4  C4  UNL     1      -1.178  -0.319   0.553  1.00  0.00           C  
HETATM    5  N1  UNL     1       0.089  -0.649   0.919  1.00  0.00           N  
HETATM    6  C5  UNL     1       0.955   0.012   0.155  1.00  0.00           C  
HETATM    7  C6  UNL     1       2.447  -0.048   0.211  1.00  0.00           C  
HETATM    8  C7  UNL     1       3.066  -0.859   1.133  1.00  0.00           C  
HETATM    9  S1  UNL     1       4.717  -0.588   0.809  1.00  0.00           S  
HETATM   10  C8  UNL     1       4.544   0.529  -0.469  1.00  0.00           C  
HETATM   11  N2  UNL     1       3.242   0.636  -0.580  1.00  0.00           N  
HETATM   12  N3  UNL     1       0.224   0.774  -0.711  1.00  0.00           N  
HETATM   13  C9  UNL     1      -1.086   0.585  -0.483  1.00  0.00           C  
HETATM   14  C10 UNL     1      -2.260   1.067  -1.025  1.00  0.00           C  
HETATM   15  H1  UNL     1      -4.427   1.083  -1.024  1.00  0.00           H  
HETATM   16  H2  UNL     1      -4.524  -0.520   0.813  1.00  0.00           H  
HETATM   17  H3  UNL     1      -2.416  -1.438   1.845  1.00  0.00           H  
HETATM   18  H4  UNL     1       0.362  -1.313   1.677  1.00  0.00           H  
HETATM   19  H5  UNL     1       2.594  -1.513   1.887  1.00  0.00           H  
HETATM   20  H6  UNL     1       5.330   1.046  -1.068  1.00  0.00           H  
HETATM   21  H7  UNL     1      -2.225   1.778  -1.839  1.00  0.00           H  
CONECT    1    2    2   14   15
CONECT    2    3   16
CONECT    3    4    4   17
CONECT    4    5   13
CONECT    5    6   18
CONECT    6    7   12   12
CONECT    7    8    8   11
CONECT    8    9   19
CONECT    9   10
CONECT   10   11   11   20
CONECT   12   13
CONECT   13   14   14
CONECT   14   21
END