COMPND HMDB0014980 HETATM 1 O1 UNL 1 -2.607 -3.362 0.943 1.00 0.00 O HETATM 2 C1 UNL 1 -2.202 -2.309 0.403 1.00 0.00 C HETATM 3 N1 UNL 1 -2.541 -1.082 1.086 1.00 0.00 N HETATM 4 C2 UNL 1 -2.055 0.206 0.728 1.00 0.00 C HETATM 5 C3 UNL 1 -2.901 1.246 1.017 1.00 0.00 C HETATM 6 C4 UNL 1 -2.536 2.522 0.591 1.00 0.00 C HETATM 7 C5 UNL 1 -1.359 2.759 -0.109 1.00 0.00 C HETATM 8 CL1 UNL 1 -0.944 4.404 -0.621 1.00 0.00 CL HETATM 9 C6 UNL 1 -0.520 1.711 -0.392 1.00 0.00 C HETATM 10 C7 UNL 1 -0.867 0.447 0.029 1.00 0.00 C HETATM 11 C8 UNL 1 0.136 -0.550 -0.305 1.00 0.00 C HETATM 12 C9 UNL 1 1.526 -0.134 -0.215 1.00 0.00 C HETATM 13 C10 UNL 1 2.511 -0.986 -0.731 1.00 0.00 C HETATM 14 C11 UNL 1 3.816 -0.681 -0.522 1.00 0.00 C HETATM 15 C12 UNL 1 4.240 0.436 0.179 1.00 0.00 C HETATM 16 C13 UNL 1 3.270 1.260 0.680 1.00 0.00 C HETATM 17 C14 UNL 1 1.910 0.970 0.480 1.00 0.00 C HETATM 18 N2 UNL 1 -0.085 -1.783 -0.703 1.00 0.00 N HETATM 19 C15 UNL 1 -1.420 -2.383 -0.875 1.00 0.00 C HETATM 20 O2 UNL 1 -1.332 -3.653 -1.356 1.00 0.00 O HETATM 21 H1 UNL 1 -3.185 -1.086 1.888 1.00 0.00 H HETATM 22 H2 UNL 1 -3.789 1.004 1.555 1.00 0.00 H HETATM 23 H3 UNL 1 -3.186 3.336 0.811 1.00 0.00 H HETATM 24 H4 UNL 1 0.380 1.816 -0.980 1.00 0.00 H HETATM 25 H5 UNL 1 2.162 -1.855 -1.277 1.00 0.00 H HETATM 26 H6 UNL 1 4.590 -1.336 -0.918 1.00 0.00 H HETATM 27 H7 UNL 1 5.273 0.673 0.341 1.00 0.00 H HETATM 28 H8 UNL 1 3.571 2.136 1.229 1.00 0.00 H HETATM 29 H9 UNL 1 1.260 1.675 0.988 1.00 0.00 H HETATM 30 H10 UNL 1 -1.943 -1.744 -1.607 1.00 0.00 H HETATM 31 H11 UNL 1 -1.174 -3.656 -2.337 1.00 0.00 H CONECT 1 2 2 CONECT 2 3 19 CONECT 3 4 21 CONECT 4 5 5 10 CONECT 5 6 22 CONECT 6 7 7 23 CONECT 7 8 9 CONECT 9 10 10 24 CONECT 10 11 CONECT 11 12 18 18 CONECT 12 13 13 17 CONECT 13 14 25 CONECT 14 15 15 26 CONECT 15 16 27 CONECT 16 17 17 28 CONECT 17 29 CONECT 18 19 CONECT 19 20 30 CONECT 20 31 END