COMPND    HMDB0245352
HETATM    1  C1  UNL     1       3.526   0.158   0.148  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.828   0.697  -0.910  1.00  0.00           C  
HETATM    3  C3  UNL     1       1.431   0.600  -0.907  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.733  -0.009   0.106  1.00  0.00           C  
HETATM    5  C5  UNL     1      -0.717  -0.138   0.160  1.00  0.00           C  
HETATM    6  C6  UNL     1      -1.529   0.351  -0.822  1.00  0.00           C  
HETATM    7  C7  UNL     1      -2.923   0.236  -0.786  1.00  0.00           C  
HETATM    8  C8  UNL     1      -3.502  -0.399   0.289  1.00  0.00           C  
HETATM    9  C9  UNL     1      -2.663  -0.886   1.271  1.00  0.00           C  
HETATM   10  N1  UNL     1      -1.330  -0.757   1.203  1.00  0.00           N  
HETATM   11  N2  UNL     1       1.479  -0.524   1.127  1.00  0.00           N  
HETATM   12  C10 UNL     1       2.820  -0.452   1.163  1.00  0.00           C  
HETATM   13  H1  UNL     1       4.604   0.220   0.169  1.00  0.00           H  
HETATM   14  H2  UNL     1       3.353   1.177  -1.711  1.00  0.00           H  
HETATM   15  H3  UNL     1       0.890   1.019  -1.729  1.00  0.00           H  
HETATM   16  H4  UNL     1      -1.109   0.858  -1.684  1.00  0.00           H  
HETATM   17  H5  UNL     1      -3.548   0.625  -1.565  1.00  0.00           H  
HETATM   18  H6  UNL     1      -4.589  -0.510   0.355  1.00  0.00           H  
HETATM   19  H7  UNL     1      -3.134  -1.387   2.118  1.00  0.00           H  
HETATM   20  H8  UNL     1       3.379  -0.881   2.005  1.00  0.00           H  
CONECT    1    2    2   12   13
CONECT    2    3   14
CONECT    3    4    4   15
CONECT    4    5   11
CONECT    5    6    6   10
CONECT    6    7   16
CONECT    7    8    8   17
CONECT    8    9   18
CONECT    9   10   10   19
CONECT   11   12   12
CONECT   12   20
END