COMPND HMDB0000509 HETATM 1 C1 UNL 1 -0.663 -0.995 -0.604 1.00 0.00 C HETATM 2 C2 UNL 1 -0.010 -0.271 0.498 1.00 0.00 C HETATM 3 C3 UNL 1 0.113 -0.926 1.802 1.00 0.00 C HETATM 4 C4 UNL 1 0.445 0.932 0.299 1.00 0.00 C HETATM 5 C5 UNL 1 0.376 1.674 -0.952 1.00 0.00 C HETATM 6 O1 UNL 1 0.839 2.822 -1.048 1.00 0.00 O HETATM 7 O2 UNL 1 -0.217 1.090 -2.055 1.00 0.00 O HETATM 8 H1 UNL 1 -1.041 -1.994 -0.300 1.00 0.00 H HETATM 9 H2 UNL 1 0.015 -1.150 -1.490 1.00 0.00 H HETATM 10 H3 UNL 1 -1.567 -0.410 -0.905 1.00 0.00 H HETATM 11 H4 UNL 1 0.339 -2.020 1.692 1.00 0.00 H HETATM 12 H5 UNL 1 -0.774 -0.774 2.467 1.00 0.00 H HETATM 13 H6 UNL 1 0.978 -0.528 2.408 1.00 0.00 H HETATM 14 H7 UNL 1 0.925 1.424 1.164 1.00 0.00 H HETATM 15 H8 UNL 1 0.243 1.127 -2.976 1.00 0.00 H CONECT 1 2 8 9 10 CONECT 2 3 4 4 CONECT 3 11 12 13 CONECT 4 5 14 CONECT 5 6 6 7 CONECT 7 15 END