COMPND HMDB0002899 HETATM 1 O1 UNL 1 0.449 3.026 -2.004 1.00 0.00 O HETATM 2 C1 UNL 1 0.052 2.031 -1.328 1.00 0.00 C HETATM 3 O2 UNL 1 -1.234 1.822 -1.099 1.00 0.00 O HETATM 4 C2 UNL 1 -1.683 0.805 -0.403 1.00 0.00 C HETATM 5 C3 UNL 1 -3.040 0.589 -0.165 1.00 0.00 C HETATM 6 O3 UNL 1 -3.968 1.471 -0.672 1.00 0.00 O HETATM 7 C4 UNL 1 -3.461 -0.495 0.572 1.00 0.00 C HETATM 8 O4 UNL 1 -4.821 -0.726 0.821 1.00 0.00 O HETATM 9 C5 UNL 1 -2.516 -1.358 1.066 1.00 0.00 C HETATM 10 C6 UNL 1 -1.160 -1.151 0.834 1.00 0.00 C HETATM 11 C7 UNL 1 -0.177 -1.994 1.312 1.00 0.00 C HETATM 12 O5 UNL 1 -0.570 -2.990 1.989 1.00 0.00 O HETATM 13 O6 UNL 1 1.115 -1.789 1.085 1.00 0.00 O HETATM 14 C8 UNL 1 1.553 -0.770 0.390 1.00 0.00 C HETATM 15 C9 UNL 1 2.918 -0.562 0.156 1.00 0.00 C HETATM 16 O7 UNL 1 3.828 -1.452 0.670 1.00 0.00 O HETATM 17 C10 UNL 1 3.362 0.515 -0.578 1.00 0.00 C HETATM 18 O8 UNL 1 4.695 0.784 -0.849 1.00 0.00 O HETATM 19 C11 UNL 1 2.381 1.384 -1.073 1.00 0.00 C HETATM 20 C12 UNL 1 1.036 1.191 -0.851 1.00 0.00 C HETATM 21 C13 UNL 1 0.617 0.104 -0.112 1.00 0.00 C HETATM 22 C14 UNL 1 -0.736 -0.065 0.096 1.00 0.00 C HETATM 23 H1 UNL 1 -3.676 2.280 -1.221 1.00 0.00 H HETATM 24 H2 UNL 1 -5.108 -1.528 1.364 1.00 0.00 H HETATM 25 H3 UNL 1 -2.818 -2.209 1.643 1.00 0.00 H HETATM 26 H4 UNL 1 4.808 -1.357 0.538 1.00 0.00 H HETATM 27 H5 UNL 1 5.458 0.212 -0.531 1.00 0.00 H HETATM 28 H6 UNL 1 2.699 2.233 -1.650 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 20 CONECT 3 4 CONECT 4 5 5 22 CONECT 5 6 7 CONECT 6 23 CONECT 7 8 9 9 CONECT 8 24 CONECT 9 10 25 CONECT 10 11 22 22 CONECT 11 12 12 13 CONECT 13 14 CONECT 14 15 21 21 CONECT 15 16 17 17 CONECT 16 26 CONECT 17 18 19 CONECT 18 27 CONECT 19 20 20 28 CONECT 20 21 CONECT 21 22 END