COMPND HMDB0302361 HETATM 1 O1 UNL 1 2.988 -1.107 0.706 1.00 0.00 O HETATM 2 C1 UNL 1 2.436 -0.631 -0.492 1.00 0.00 C HETATM 3 C2 UNL 1 1.241 0.198 -0.208 1.00 0.00 C HETATM 4 C3 UNL 1 1.124 1.476 -0.550 1.00 0.00 C HETATM 5 C4 UNL 1 -0.208 1.970 -0.101 1.00 0.00 C HETATM 6 N1 UNL 1 -0.831 0.868 0.556 1.00 0.00 N HETATM 7 C5 UNL 1 -2.113 0.513 0.015 1.00 0.00 C HETATM 8 C6 UNL 1 -1.963 -0.750 -0.766 1.00 0.00 C HETATM 9 C7 UNL 1 -0.681 -1.359 -0.264 1.00 0.00 C HETATM 10 C8 UNL 1 0.031 -0.264 0.483 1.00 0.00 C HETATM 11 H1 UNL 1 2.329 -1.652 1.185 1.00 0.00 H HETATM 12 H2 UNL 1 3.224 -0.058 -1.035 1.00 0.00 H HETATM 13 H3 UNL 1 2.156 -1.511 -1.119 1.00 0.00 H HETATM 14 H4 UNL 1 1.868 2.077 -1.073 1.00 0.00 H HETATM 15 H5 UNL 1 -0.779 2.328 -0.975 1.00 0.00 H HETATM 16 H6 UNL 1 -0.022 2.772 0.653 1.00 0.00 H HETATM 17 H7 UNL 1 -2.797 0.313 0.866 1.00 0.00 H HETATM 18 H8 UNL 1 -2.580 1.327 -0.575 1.00 0.00 H HETATM 19 H9 UNL 1 -2.820 -1.455 -0.593 1.00 0.00 H HETATM 20 H10 UNL 1 -1.918 -0.545 -1.847 1.00 0.00 H HETATM 21 H11 UNL 1 -0.057 -1.735 -1.102 1.00 0.00 H HETATM 22 H12 UNL 1 -0.901 -2.187 0.434 1.00 0.00 H HETATM 23 H13 UNL 1 0.276 -0.589 1.527 1.00 0.00 H CONECT 1 2 11 CONECT 2 3 12 13 CONECT 3 4 4 10 CONECT 4 5 14 CONECT 5 6 15 16 CONECT 6 7 10 CONECT 7 8 17 18 CONECT 8 9 19 20 CONECT 9 10 21 22 CONECT 10 23 END