COMPND HMDB0029874 HETATM 1 N1 UNL 1 2.781 0.549 0.098 1.00 0.00 N HETATM 2 C1 UNL 1 1.829 -0.429 -0.259 1.00 0.00 C HETATM 3 O1 UNL 1 2.219 -1.608 -0.425 1.00 0.00 O HETATM 4 N2 UNL 1 0.454 -0.148 -0.441 1.00 0.00 N HETATM 5 C2 UNL 1 -0.572 -1.100 -0.806 1.00 0.00 C HETATM 6 C3 UNL 1 -1.715 -0.664 0.108 1.00 0.00 C HETATM 7 C4 UNL 1 -1.681 0.845 -0.107 1.00 0.00 C HETATM 8 C5 UNL 1 -0.231 1.095 -0.314 1.00 0.00 C HETATM 9 O2 UNL 1 0.327 2.236 -0.371 1.00 0.00 O HETATM 10 H1 UNL 1 3.234 1.107 -0.643 1.00 0.00 H HETATM 11 H2 UNL 1 3.040 0.723 1.083 1.00 0.00 H HETATM 12 H3 UNL 1 -0.858 -0.904 -1.843 1.00 0.00 H HETATM 13 H4 UNL 1 -0.272 -2.143 -0.606 1.00 0.00 H HETATM 14 H5 UNL 1 -2.693 -1.045 -0.245 1.00 0.00 H HETATM 15 H6 UNL 1 -1.517 -0.929 1.149 1.00 0.00 H HETATM 16 H7 UNL 1 -2.086 1.381 0.754 1.00 0.00 H HETATM 17 H8 UNL 1 -2.260 1.034 -1.048 1.00 0.00 H CONECT 1 2 10 11 CONECT 2 3 3 4 CONECT 4 5 8 CONECT 5 6 12 13 CONECT 6 7 14 15 CONECT 7 8 16 17 CONECT 8 9 9 END