COMPND HMDB0011599 HETATM 1 C1 UNL 1 -2.482 0.153 -0.231 1.00 0.00 C HETATM 2 N1 UNL 1 -1.084 0.436 0.105 1.00 0.00 N HETATM 3 C2 UNL 1 -0.722 1.550 0.768 1.00 0.00 C HETATM 4 N2 UNL 1 0.573 1.770 1.056 1.00 0.00 N HETATM 5 C3 UNL 1 1.563 0.928 0.716 1.00 0.00 C HETATM 6 N3 UNL 1 2.896 0.887 0.863 1.00 0.00 N HETATM 7 C4 UNL 1 3.350 -0.245 0.294 1.00 0.00 C HETATM 8 N4 UNL 1 2.323 -0.954 -0.230 1.00 0.00 N HETATM 9 C5 UNL 1 1.187 -0.284 -0.004 1.00 0.00 C HETATM 10 C6 UNL 1 -0.151 -0.465 -0.276 1.00 0.00 C HETATM 11 N5 UNL 1 -0.519 -1.640 -0.974 1.00 0.00 N HETATM 12 H1 UNL 1 -3.094 1.060 -0.022 1.00 0.00 H HETATM 13 H2 UNL 1 -2.882 -0.665 0.411 1.00 0.00 H HETATM 14 H3 UNL 1 -2.549 -0.120 -1.305 1.00 0.00 H HETATM 15 H4 UNL 1 -1.507 2.244 1.053 1.00 0.00 H HETATM 16 H5 UNL 1 4.395 -0.534 0.267 1.00 0.00 H HETATM 17 H6 UNL 1 -0.939 -2.444 -0.473 1.00 0.00 H HETATM 18 H7 UNL 1 -0.357 -1.679 -2.017 1.00 0.00 H CONECT 1 2 12 13 14 CONECT 2 3 10 CONECT 3 4 4 15 CONECT 4 5 CONECT 5 6 6 9 CONECT 6 7 CONECT 7 8 8 16 CONECT 8 9 CONECT 9 10 10 CONECT 10 11 CONECT 11 17 18 END