COMPND HMDB0031157 HETATM 1 C1 UNL 1 1.464 -0.938 0.111 1.00 0.00 C HETATM 2 C2 UNL 1 0.605 0.211 0.496 1.00 0.00 C HETATM 3 S1 UNL 1 1.634 1.705 0.519 1.00 0.00 S HETATM 4 C3 UNL 1 -0.597 0.402 -0.379 1.00 0.00 C HETATM 5 C4 UNL 1 -1.539 -0.735 -0.421 1.00 0.00 C HETATM 6 S2 UNL 1 -1.493 1.889 0.137 1.00 0.00 S HETATM 7 H1 UNL 1 1.037 -1.927 0.397 1.00 0.00 H HETATM 8 H2 UNL 1 1.743 -0.892 -0.968 1.00 0.00 H HETATM 9 H3 UNL 1 2.437 -0.831 0.670 1.00 0.00 H HETATM 10 H4 UNL 1 0.222 0.027 1.542 1.00 0.00 H HETATM 11 H5 UNL 1 2.167 1.852 -0.791 1.00 0.00 H HETATM 12 H6 UNL 1 -0.221 0.586 -1.416 1.00 0.00 H HETATM 13 H7 UNL 1 -2.231 -0.588 -1.279 1.00 0.00 H HETATM 14 H8 UNL 1 -1.083 -1.730 -0.550 1.00 0.00 H HETATM 15 H9 UNL 1 -2.198 -0.808 0.482 1.00 0.00 H HETATM 16 H10 UNL 1 -1.945 1.778 1.451 1.00 0.00 H CONECT 1 2 7 8 9 CONECT 2 3 4 10 CONECT 3 11 CONECT 4 5 6 12 CONECT 5 13 14 15 CONECT 6 16 END