COMPND HMDB0060497 HETATM 1 O1 UNL 1 3.524 0.183 0.517 1.00 0.00 O HETATM 2 C1 UNL 1 2.162 0.390 0.376 1.00 0.00 C HETATM 3 C2 UNL 1 1.635 1.645 0.570 1.00 0.00 C HETATM 4 C3 UNL 1 0.289 1.897 0.440 1.00 0.00 C HETATM 5 C4 UNL 1 -0.559 0.841 0.102 1.00 0.00 C HETATM 6 C5 UNL 1 -1.915 1.037 -0.041 1.00 0.00 C HETATM 7 C6 UNL 1 -2.797 0.030 -0.373 1.00 0.00 C HETATM 8 C7 UNL 1 -2.273 -1.228 -0.568 1.00 0.00 C HETATM 9 C8 UNL 1 -0.923 -1.477 -0.437 1.00 0.00 C HETATM 10 C9 UNL 1 -0.069 -0.446 -0.104 1.00 0.00 C HETATM 11 C10 UNL 1 1.301 -0.656 0.038 1.00 0.00 C HETATM 12 O2 UNL 1 1.876 -1.891 -0.145 1.00 0.00 O HETATM 13 H1 UNL 1 3.928 -0.735 0.378 1.00 0.00 H HETATM 14 H2 UNL 1 2.275 2.497 0.837 1.00 0.00 H HETATM 15 H3 UNL 1 -0.165 2.853 0.581 1.00 0.00 H HETATM 16 H4 UNL 1 -2.294 2.049 0.122 1.00 0.00 H HETATM 17 H5 UNL 1 -3.870 0.231 -0.476 1.00 0.00 H HETATM 18 H6 UNL 1 -2.909 -2.057 -0.830 1.00 0.00 H HETATM 19 H7 UNL 1 -0.551 -2.482 -0.599 1.00 0.00 H HETATM 20 H8 UNL 1 1.336 -2.684 -0.386 1.00 0.00 H CONECT 1 2 13 CONECT 2 3 3 11 CONECT 3 4 14 CONECT 4 5 5 15 CONECT 5 6 10 CONECT 6 7 7 16 CONECT 7 8 17 CONECT 8 9 9 18 CONECT 9 10 19 CONECT 10 11 11 CONECT 11 12 CONECT 12 20 END