COMPND HMDB0034615 HETATM 1 C1 UNL 1 4.300 0.602 0.647 1.00 0.00 C HETATM 2 O1 UNL 1 3.284 1.103 -0.186 1.00 0.00 O HETATM 3 C2 UNL 1 2.020 0.538 -0.170 1.00 0.00 C HETATM 4 C3 UNL 1 1.763 -0.523 0.671 1.00 0.00 C HETATM 5 C4 UNL 1 0.492 -1.078 0.674 1.00 0.00 C HETATM 6 C5 UNL 1 -0.475 -0.573 -0.142 1.00 0.00 C HETATM 7 C6 UNL 1 -1.858 -1.104 -0.203 1.00 0.00 C HETATM 8 O2 UNL 1 -2.553 -1.395 0.938 1.00 0.00 O HETATM 9 C7 UNL 1 -2.871 -0.161 0.445 1.00 0.00 C HETATM 10 C8 UNL 1 -4.087 0.072 -0.396 1.00 0.00 C HETATM 11 C9 UNL 1 -0.189 0.500 -0.982 1.00 0.00 C HETATM 12 C10 UNL 1 1.063 1.072 -1.009 1.00 0.00 C HETATM 13 H1 UNL 1 3.949 0.461 1.696 1.00 0.00 H HETATM 14 H2 UNL 1 4.710 -0.329 0.217 1.00 0.00 H HETATM 15 H3 UNL 1 5.108 1.390 0.665 1.00 0.00 H HETATM 16 H4 UNL 1 2.512 -0.950 1.334 1.00 0.00 H HETATM 17 H5 UNL 1 0.281 -1.895 1.317 1.00 0.00 H HETATM 18 H6 UNL 1 -2.148 -1.660 -1.093 1.00 0.00 H HETATM 19 H7 UNL 1 -2.522 0.704 1.009 1.00 0.00 H HETATM 20 H8 UNL 1 -3.719 0.424 -1.402 1.00 0.00 H HETATM 21 H9 UNL 1 -4.617 -0.877 -0.577 1.00 0.00 H HETATM 22 H10 UNL 1 -4.743 0.863 0.042 1.00 0.00 H HETATM 23 H11 UNL 1 -0.958 0.905 -1.635 1.00 0.00 H HETATM 24 H12 UNL 1 1.258 1.911 -1.676 1.00 0.00 H CONECT 1 2 13 14 15 CONECT 2 3 CONECT 3 4 4 12 CONECT 4 5 16 CONECT 5 6 6 17 CONECT 6 7 11 CONECT 7 8 9 18 CONECT 8 9 CONECT 9 10 19 CONECT 10 20 21 22 CONECT 11 12 12 23 CONECT 12 24 END