COMPND HMDB0032706 HETATM 1 O1 UNL 1 4.046 2.311 -0.822 1.00 0.00 O HETATM 2 C1 UNL 1 3.364 1.287 -0.556 1.00 0.00 C HETATM 3 O2 UNL 1 2.979 1.003 0.746 1.00 0.00 O HETATM 4 C2 UNL 1 2.981 0.390 -1.669 1.00 0.00 C HETATM 5 O3 UNL 1 2.209 -0.699 -1.307 1.00 0.00 O HETATM 6 C3 UNL 1 0.974 -0.731 -0.730 1.00 0.00 C HETATM 7 C4 UNL 1 0.414 -1.986 -0.459 1.00 0.00 C HETATM 8 C5 UNL 1 -0.822 -2.125 0.119 1.00 0.00 C HETATM 9 C6 UNL 1 -1.564 -1.016 0.458 1.00 0.00 C HETATM 10 C7 UNL 1 -2.804 -1.097 1.039 1.00 0.00 C HETATM 11 C8 UNL 1 -3.541 0.017 1.375 1.00 0.00 C HETATM 12 C9 UNL 1 -3.001 1.268 1.114 1.00 0.00 C HETATM 13 C10 UNL 1 -1.761 1.379 0.534 1.00 0.00 C HETATM 14 C11 UNL 1 -1.050 0.242 0.209 1.00 0.00 C HETATM 15 C12 UNL 1 0.213 0.363 -0.382 1.00 0.00 C HETATM 16 H1 UNL 1 3.085 0.084 1.174 1.00 0.00 H HETATM 17 H2 UNL 1 2.535 1.012 -2.474 1.00 0.00 H HETATM 18 H3 UNL 1 3.933 -0.015 -2.122 1.00 0.00 H HETATM 19 H4 UNL 1 0.981 -2.878 -0.718 1.00 0.00 H HETATM 20 H5 UNL 1 -1.271 -3.094 0.336 1.00 0.00 H HETATM 21 H6 UNL 1 -3.192 -2.090 1.227 1.00 0.00 H HETATM 22 H7 UNL 1 -4.518 -0.115 1.833 1.00 0.00 H HETATM 23 H8 UNL 1 -3.535 2.154 1.358 1.00 0.00 H HETATM 24 H9 UNL 1 -1.285 2.321 0.305 1.00 0.00 H HETATM 25 H10 UNL 1 0.628 1.340 -0.588 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 4 CONECT 3 16 CONECT 4 5 17 18 CONECT 5 6 CONECT 6 7 7 15 CONECT 7 8 19 CONECT 8 9 9 20 CONECT 9 10 14 CONECT 10 11 11 21 CONECT 11 12 22 CONECT 12 13 13 23 CONECT 13 14 24 CONECT 14 15 15 CONECT 15 25 END