COMPND HMDB0000128 HETATM 1 N1 UNL 1 2.062 -1.197 -0.476 1.00 0.00 N HETATM 2 C1 UNL 1 1.459 -0.165 -0.022 1.00 0.00 C HETATM 3 N2 UNL 1 1.856 1.115 -0.470 1.00 0.00 N HETATM 4 N3 UNL 1 0.416 -0.284 0.909 1.00 0.00 N HETATM 5 C2 UNL 1 -0.917 0.213 0.717 1.00 0.00 C HETATM 6 C3 UNL 1 -1.652 -0.508 -0.325 1.00 0.00 C HETATM 7 O1 UNL 1 -1.088 -1.447 -0.931 1.00 0.00 O HETATM 8 O2 UNL 1 -2.952 -0.177 -0.654 1.00 0.00 O HETATM 9 H1 UNL 1 1.845 -2.175 -0.210 1.00 0.00 H HETATM 10 H2 UNL 1 2.275 1.771 0.220 1.00 0.00 H HETATM 11 H3 UNL 1 1.747 1.431 -1.472 1.00 0.00 H HETATM 12 H4 UNL 1 0.637 -0.775 1.808 1.00 0.00 H HETATM 13 H5 UNL 1 -1.467 0.117 1.673 1.00 0.00 H HETATM 14 H6 UNL 1 -0.924 1.327 0.515 1.00 0.00 H HETATM 15 H7 UNL 1 -3.297 0.754 -0.748 1.00 0.00 H CONECT 1 2 2 9 CONECT 2 3 4 CONECT 3 10 11 CONECT 4 5 12 CONECT 5 6 13 14 CONECT 6 7 7 8 CONECT 8 15 END