COMPND HMDB0245315 HETATM 1 C1 UNL 1 -1.839 -0.005 1.795 1.00 0.00 C HETATM 2 C2 UNL 1 -1.966 -0.490 0.357 1.00 0.00 C HETATM 3 C3 UNL 1 -1.022 0.303 -0.530 1.00 0.00 C HETATM 4 C4 UNL 1 -1.225 -0.257 -1.946 1.00 0.00 C HETATM 5 C5 UNL 1 0.376 0.127 -0.131 1.00 0.00 C HETATM 6 C6 UNL 1 0.822 -1.047 0.471 1.00 0.00 C HETATM 7 C7 UNL 1 2.150 -1.222 0.765 1.00 0.00 C HETATM 8 C8 UNL 1 3.073 -0.242 0.475 1.00 0.00 C HETATM 9 C9 UNL 1 2.653 0.937 -0.119 1.00 0.00 C HETATM 10 C10 UNL 1 1.316 1.090 -0.409 1.00 0.00 C HETATM 11 O1 UNL 1 0.943 2.284 -1.006 1.00 0.00 O HETATM 12 H1 UNL 1 -1.859 -0.830 2.512 1.00 0.00 H HETATM 13 H2 UNL 1 -2.730 0.660 2.005 1.00 0.00 H HETATM 14 H3 UNL 1 -0.929 0.581 1.901 1.00 0.00 H HETATM 15 H4 UNL 1 -1.779 -1.566 0.335 1.00 0.00 H HETATM 16 H5 UNL 1 -3.021 -0.322 0.038 1.00 0.00 H HETATM 17 H6 UNL 1 -1.370 1.334 -0.562 1.00 0.00 H HETATM 18 H7 UNL 1 -0.354 -0.890 -2.265 1.00 0.00 H HETATM 19 H8 UNL 1 -1.322 0.541 -2.704 1.00 0.00 H HETATM 20 H9 UNL 1 -2.098 -0.945 -1.976 1.00 0.00 H HETATM 21 H10 UNL 1 0.131 -1.843 0.713 1.00 0.00 H HETATM 22 H11 UNL 1 2.529 -2.132 1.243 1.00 0.00 H HETATM 23 H12 UNL 1 4.115 -0.341 0.680 1.00 0.00 H HETATM 24 H13 UNL 1 3.352 1.701 -0.366 1.00 0.00 H HETATM 25 H14 UNL 1 0.053 2.573 -1.275 1.00 0.00 H CONECT 1 2 12 13 14 CONECT 2 3 15 16 CONECT 3 4 5 17 CONECT 4 18 19 20 CONECT 5 6 6 10 CONECT 6 7 21 CONECT 7 8 8 22 CONECT 8 9 23 CONECT 9 10 10 24 CONECT 10 11 CONECT 11 25 END