COMPND HMDB0253886 HETATM 1 O1 UNL 1 3.538 1.025 -1.213 1.00 0.00 O HETATM 2 C1 UNL 1 2.519 1.029 -0.475 1.00 0.00 C HETATM 3 O2 UNL 1 1.819 2.201 -0.399 1.00 0.00 O HETATM 4 C2 UNL 1 2.123 -0.175 0.261 1.00 0.00 C HETATM 5 O3 UNL 1 3.195 -1.142 0.084 1.00 0.00 O HETATM 6 C3 UNL 1 0.868 -0.857 -0.190 1.00 0.00 C HETATM 7 O4 UNL 1 0.821 -1.224 -1.512 1.00 0.00 O HETATM 8 C4 UNL 1 -0.409 -0.434 0.437 1.00 0.00 C HETATM 9 O5 UNL 1 -1.323 -1.557 0.440 1.00 0.00 O HETATM 10 C5 UNL 1 -1.194 0.611 -0.323 1.00 0.00 C HETATM 11 O6 UNL 1 -1.485 0.240 -1.607 1.00 0.00 O HETATM 12 C6 UNL 1 -2.561 0.825 0.365 1.00 0.00 C HETATM 13 O7 UNL 1 -2.366 1.210 1.695 1.00 0.00 O HETATM 14 H1 UNL 1 1.919 2.877 0.364 1.00 0.00 H HETATM 15 H2 UNL 1 2.057 -0.049 1.358 1.00 0.00 H HETATM 16 H3 UNL 1 2.836 -1.941 0.518 1.00 0.00 H HETATM 17 H4 UNL 1 1.013 -1.929 0.327 1.00 0.00 H HETATM 18 H5 UNL 1 0.450 -2.119 -1.684 1.00 0.00 H HETATM 19 H6 UNL 1 -0.323 -0.156 1.493 1.00 0.00 H HETATM 20 H7 UNL 1 -1.155 -1.998 -0.431 1.00 0.00 H HETATM 21 H8 UNL 1 -0.694 1.571 -0.253 1.00 0.00 H HETATM 22 H9 UNL 1 -2.316 -0.306 -1.699 1.00 0.00 H HETATM 23 H10 UNL 1 -3.116 -0.137 0.371 1.00 0.00 H HETATM 24 H11 UNL 1 -3.124 1.568 -0.207 1.00 0.00 H HETATM 25 H12 UNL 1 -3.094 0.868 2.281 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 4 CONECT 3 14 CONECT 4 5 6 15 CONECT 5 16 CONECT 6 7 8 17 CONECT 7 18 CONECT 8 9 10 19 CONECT 9 20 CONECT 10 11 12 21 CONECT 11 22 CONECT 12 13 23 24 CONECT 13 25 END