COMPND HMDB0000209 HETATM 1 O1 UNL 1 1.844 -1.194 -1.417 1.00 0.00 O HETATM 2 C1 UNL 1 2.304 -0.551 -0.446 1.00 0.00 C HETATM 3 O2 UNL 1 3.677 -0.574 -0.253 1.00 0.00 O HETATM 4 C2 UNL 1 1.477 0.211 0.482 1.00 0.00 C HETATM 5 C3 UNL 1 0.033 0.159 0.172 1.00 0.00 C HETATM 6 C4 UNL 1 -0.800 -0.807 0.697 1.00 0.00 C HETATM 7 C5 UNL 1 -2.130 -0.758 0.337 1.00 0.00 C HETATM 8 C6 UNL 1 -2.630 0.203 -0.509 1.00 0.00 C HETATM 9 C7 UNL 1 -1.807 1.165 -1.034 1.00 0.00 C HETATM 10 C8 UNL 1 -0.475 1.121 -0.677 1.00 0.00 C HETATM 11 H1 UNL 1 4.076 -0.932 0.620 1.00 0.00 H HETATM 12 H2 UNL 1 1.753 1.285 0.537 1.00 0.00 H HETATM 13 H3 UNL 1 1.583 -0.229 1.515 1.00 0.00 H HETATM 14 H4 UNL 1 -0.384 -1.548 1.357 1.00 0.00 H HETATM 15 H5 UNL 1 -2.769 -1.529 0.764 1.00 0.00 H HETATM 16 H6 UNL 1 -3.692 0.166 -0.739 1.00 0.00 H HETATM 17 H7 UNL 1 -2.222 1.910 -1.697 1.00 0.00 H HETATM 18 H8 UNL 1 0.161 1.902 -1.111 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 4 CONECT 3 11 CONECT 4 5 12 13 CONECT 5 6 6 10 CONECT 6 7 14 CONECT 7 8 8 15 CONECT 8 9 16 CONECT 9 10 10 17 CONECT 10 18 END