COMPND HMDB0031719 HETATM 1 C1 UNL 1 -0.126 1.120 1.061 1.00 0.00 C HETATM 2 S1 UNL 1 1.348 1.132 0.071 1.00 0.00 S HETATM 3 C2 UNL 1 2.093 -0.468 -0.193 1.00 0.00 C HETATM 4 S2 UNL 1 0.918 -1.717 -0.772 1.00 0.00 S HETATM 5 S3 UNL 1 -0.716 -0.835 -1.792 1.00 0.00 S HETATM 6 C3 UNL 1 -2.013 -0.328 -0.632 1.00 0.00 C HETATM 7 S4 UNL 1 -1.564 1.349 -0.045 1.00 0.00 S HETATM 8 H1 UNL 1 -0.300 0.223 1.658 1.00 0.00 H HETATM 9 H2 UNL 1 -0.102 1.987 1.766 1.00 0.00 H HETATM 10 H3 UNL 1 2.873 -0.360 -0.987 1.00 0.00 H HETATM 11 H4 UNL 1 2.636 -0.862 0.701 1.00 0.00 H HETATM 12 H5 UNL 1 -3.004 -0.286 -1.113 1.00 0.00 H HETATM 13 H6 UNL 1 -2.043 -0.956 0.278 1.00 0.00 H CONECT 1 2 7 8 9 CONECT 2 3 CONECT 3 4 10 11 CONECT 4 5 CONECT 5 6 CONECT 6 7 12 13 END