COMPND HMDB0000703 HETATM 1 O1 UNL 1 1.744 1.566 1.395 1.00 0.00 O HETATM 2 C1 UNL 1 2.077 0.529 0.800 1.00 0.00 C HETATM 3 O2 UNL 1 3.116 -0.258 1.276 1.00 0.00 O HETATM 4 C2 UNL 1 1.384 0.097 -0.427 1.00 0.00 C HETATM 5 O3 UNL 1 1.916 -1.088 -0.929 1.00 0.00 O HETATM 6 C3 UNL 1 -0.082 0.009 -0.250 1.00 0.00 C HETATM 7 C4 UNL 1 -0.909 1.044 -0.666 1.00 0.00 C HETATM 8 C5 UNL 1 -2.286 0.990 -0.514 1.00 0.00 C HETATM 9 C6 UNL 1 -2.878 -0.108 0.062 1.00 0.00 C HETATM 10 C7 UNL 1 -2.070 -1.160 0.488 1.00 0.00 C HETATM 11 C8 UNL 1 -0.701 -1.081 0.324 1.00 0.00 C HETATM 12 H1 UNL 1 4.076 -0.142 0.915 1.00 0.00 H HETATM 13 H2 UNL 1 1.581 0.875 -1.204 1.00 0.00 H HETATM 14 H3 UNL 1 2.893 -0.897 -1.087 1.00 0.00 H HETATM 15 H4 UNL 1 -0.445 1.924 -1.127 1.00 0.00 H HETATM 16 H5 UNL 1 -2.884 1.835 -0.861 1.00 0.00 H HETATM 17 H6 UNL 1 -3.948 -0.182 0.196 1.00 0.00 H HETATM 18 H7 UNL 1 -2.520 -2.045 0.950 1.00 0.00 H HETATM 19 H8 UNL 1 -0.065 -1.909 0.660 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 4 CONECT 3 12 CONECT 4 5 6 13 CONECT 5 14 CONECT 6 7 7 11 CONECT 7 8 15 CONECT 8 9 9 16 CONECT 9 10 17 CONECT 10 11 11 18 CONECT 11 19 END