COMPND HMDB0059602 HETATM 1 O1 UNL 1 -1.586 2.542 -0.136 1.00 0.00 O HETATM 2 C1 UNL 1 -1.308 1.331 -0.188 1.00 0.00 C HETATM 3 C2 UNL 1 -2.242 0.156 -0.346 1.00 0.00 C HETATM 4 C3 UNL 1 -1.525 -0.898 0.460 1.00 0.00 C HETATM 5 C4 UNL 1 -0.105 -0.601 0.261 1.00 0.00 C HETATM 6 C5 UNL 1 1.071 -1.365 0.381 1.00 0.00 C HETATM 7 C6 UNL 1 2.280 -0.785 0.130 1.00 0.00 C HETATM 8 C7 UNL 1 2.434 0.533 -0.242 1.00 0.00 C HETATM 9 C8 UNL 1 1.278 1.276 -0.358 1.00 0.00 C HETATM 10 C9 UNL 1 0.019 0.714 -0.109 1.00 0.00 C HETATM 11 H1 UNL 1 -2.293 -0.180 -1.397 1.00 0.00 H HETATM 12 H2 UNL 1 -3.241 0.395 0.087 1.00 0.00 H HETATM 13 H3 UNL 1 -1.798 -0.722 1.521 1.00 0.00 H HETATM 14 H4 UNL 1 -1.822 -1.909 0.121 1.00 0.00 H HETATM 15 H5 UNL 1 0.912 -2.388 0.673 1.00 0.00 H HETATM 16 H6 UNL 1 3.182 -1.387 0.226 1.00 0.00 H HETATM 17 H7 UNL 1 3.405 0.967 -0.435 1.00 0.00 H HETATM 18 H8 UNL 1 1.341 2.321 -0.649 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 10 CONECT 3 4 11 12 CONECT 4 5 13 14 CONECT 5 6 6 10 CONECT 6 7 15 CONECT 7 8 8 16 CONECT 8 9 17 CONECT 9 10 10 18 END