COMPND HMDB0255849 HETATM 1 C1 UNL 1 -1.480 1.788 0.672 1.00 0.00 C HETATM 2 N1 UNL 1 -1.908 0.415 0.513 1.00 0.00 N HETATM 3 C2 UNL 1 -1.498 -0.233 -0.649 1.00 0.00 C HETATM 4 C3 UNL 1 -2.669 -1.028 -1.233 1.00 0.00 C HETATM 5 C4 UNL 1 -0.311 -1.151 -0.603 1.00 0.00 C HETATM 6 C5 UNL 1 0.958 -0.531 -0.191 1.00 0.00 C HETATM 7 C6 UNL 1 1.474 0.552 -0.922 1.00 0.00 C HETATM 8 C7 UNL 1 2.603 1.219 -0.520 1.00 0.00 C HETATM 9 C8 UNL 1 3.282 0.833 0.646 1.00 0.00 C HETATM 10 C9 UNL 1 2.782 -0.227 1.364 1.00 0.00 C HETATM 11 C10 UNL 1 1.619 -0.909 0.949 1.00 0.00 C HETATM 12 O1 UNL 1 1.234 -1.957 1.791 1.00 0.00 O HETATM 13 H1 UNL 1 -1.490 2.325 -0.299 1.00 0.00 H HETATM 14 H2 UNL 1 -2.223 2.251 1.342 1.00 0.00 H HETATM 15 H3 UNL 1 -0.510 1.834 1.212 1.00 0.00 H HETATM 16 H4 UNL 1 -2.903 0.268 0.805 1.00 0.00 H HETATM 17 H5 UNL 1 -1.313 0.574 -1.440 1.00 0.00 H HETATM 18 H6 UNL 1 -3.533 -0.349 -1.390 1.00 0.00 H HETATM 19 H7 UNL 1 -2.356 -1.487 -2.211 1.00 0.00 H HETATM 20 H8 UNL 1 -2.958 -1.784 -0.480 1.00 0.00 H HETATM 21 H9 UNL 1 -0.199 -1.643 -1.583 1.00 0.00 H HETATM 22 H10 UNL 1 -0.570 -1.972 0.163 1.00 0.00 H HETATM 23 H11 UNL 1 0.987 0.889 -1.811 1.00 0.00 H HETATM 24 H12 UNL 1 3.032 2.059 -1.050 1.00 0.00 H HETATM 25 H13 UNL 1 4.182 1.334 0.969 1.00 0.00 H HETATM 26 H14 UNL 1 3.304 -0.549 2.252 1.00 0.00 H HETATM 27 H15 UNL 1 0.464 -2.523 1.701 1.00 0.00 H CONECT 1 2 13 14 15 CONECT 2 3 16 CONECT 3 4 5 17 CONECT 4 18 19 20 CONECT 5 6 21 22 CONECT 6 7 7 11 CONECT 7 8 23 CONECT 8 9 9 24 CONECT 9 10 25 CONECT 10 11 11 26 CONECT 11 12 CONECT 12 27 END