COMPND HMDB0252612 HETATM 1 CL1 UNL 1 -1.476 2.072 -2.077 1.00 0.00 CL HETATM 2 C1 UNL 1 -1.269 0.701 -1.015 1.00 0.00 C HETATM 3 C2 UNL 1 -1.016 -0.542 -1.412 1.00 0.00 C HETATM 4 CL2 UNL 1 -0.869 -1.201 -3.026 1.00 0.00 CL HETATM 5 C3 UNL 1 -0.861 -1.366 -0.174 1.00 0.00 C HETATM 6 CL3 UNL 1 -1.034 -3.051 -0.351 1.00 0.00 CL HETATM 7 C4 UNL 1 0.378 -0.892 0.583 1.00 0.00 C HETATM 8 C5 UNL 1 1.588 -0.811 -0.267 1.00 0.00 C HETATM 9 C6 UNL 1 2.006 0.618 -0.373 1.00 0.00 C HETATM 10 CL4 UNL 1 1.990 1.101 -2.100 1.00 0.00 CL HETATM 11 CL5 UNL 1 3.705 0.830 0.177 1.00 0.00 CL HETATM 12 C7 UNL 1 1.061 1.433 0.448 1.00 0.00 C HETATM 13 C8 UNL 1 0.040 0.519 1.045 1.00 0.00 C HETATM 14 C9 UNL 1 -1.346 0.727 0.470 1.00 0.00 C HETATM 15 CL6 UNL 1 -2.267 1.995 1.161 1.00 0.00 CL HETATM 16 C10 UNL 1 -1.929 -0.684 0.704 1.00 0.00 C HETATM 17 CL7 UNL 1 -3.536 -0.846 0.028 1.00 0.00 CL HETATM 18 CL8 UNL 1 -1.802 -1.170 2.384 1.00 0.00 CL HETATM 19 H1 UNL 1 0.470 -1.514 1.486 1.00 0.00 H HETATM 20 H2 UNL 1 2.411 -1.374 0.252 1.00 0.00 H HETATM 21 H3 UNL 1 1.483 -1.322 -1.257 1.00 0.00 H HETATM 22 H4 UNL 1 1.655 1.876 1.293 1.00 0.00 H HETATM 23 H5 UNL 1 0.632 2.288 -0.111 1.00 0.00 H HETATM 24 H6 UNL 1 -0.014 0.612 2.132 1.00 0.00 H CONECT 1 2 CONECT 2 3 3 14 CONECT 3 4 5 CONECT 5 6 7 16 CONECT 7 8 13 19 CONECT 8 9 20 21 CONECT 9 10 11 12 CONECT 12 13 22 23 CONECT 13 14 24 CONECT 14 15 16 CONECT 16 17 18 END