COMPND HMDB0245018 HETATM 1 N1 UNL 1 4.336 -0.797 0.603 1.00 0.00 N HETATM 2 C1 UNL 1 2.997 -0.424 0.301 1.00 0.00 C HETATM 3 C2 UNL 1 2.739 0.584 -0.611 1.00 0.00 C HETATM 4 C3 UNL 1 1.433 0.948 -0.906 1.00 0.00 C HETATM 5 C4 UNL 1 0.348 0.323 -0.305 1.00 0.00 C HETATM 6 C5 UNL 1 0.600 -0.675 0.599 1.00 0.00 C HETATM 7 C6 UNL 1 1.923 -1.044 0.897 1.00 0.00 C HETATM 8 C7 UNL 1 -0.698 -1.173 1.091 1.00 0.00 C HETATM 9 C8 UNL 1 -1.719 -0.368 0.385 1.00 0.00 C HETATM 10 C9 UNL 1 -3.116 -0.399 0.453 1.00 0.00 C HETATM 11 C10 UNL 1 -3.857 0.465 -0.314 1.00 0.00 C HETATM 12 C11 UNL 1 -3.244 1.379 -1.165 1.00 0.00 C HETATM 13 C12 UNL 1 -1.867 1.384 -1.209 1.00 0.00 C HETATM 14 C13 UNL 1 -1.087 0.523 -0.446 1.00 0.00 C HETATM 15 H1 UNL 1 4.809 -1.622 0.181 1.00 0.00 H HETATM 16 H2 UNL 1 4.896 -0.232 1.279 1.00 0.00 H HETATM 17 H3 UNL 1 3.581 1.066 -1.075 1.00 0.00 H HETATM 18 H4 UNL 1 1.211 1.734 -1.616 1.00 0.00 H HETATM 19 H5 UNL 1 2.095 -1.837 1.617 1.00 0.00 H HETATM 20 H6 UNL 1 -0.883 -2.234 0.794 1.00 0.00 H HETATM 21 H7 UNL 1 -0.751 -1.042 2.191 1.00 0.00 H HETATM 22 H8 UNL 1 -3.601 -1.106 1.113 1.00 0.00 H HETATM 23 H9 UNL 1 -4.946 0.428 -0.249 1.00 0.00 H HETATM 24 H10 UNL 1 -3.858 2.051 -1.761 1.00 0.00 H HETATM 25 H11 UNL 1 -1.340 2.067 -1.848 1.00 0.00 H CONECT 1 2 15 16 CONECT 2 3 3 7 CONECT 3 4 17 CONECT 4 5 5 18 CONECT 5 6 14 CONECT 6 7 7 8 CONECT 7 19 CONECT 8 9 20 21 CONECT 9 10 10 14 CONECT 10 11 22 CONECT 11 12 12 23 CONECT 12 13 24 CONECT 13 14 14 25 END