COMPND HMDB0256151 HETATM 1 C1 UNL 1 -3.096 -0.497 0.958 1.00 0.00 C HETATM 2 N1 UNL 1 -2.891 0.538 -0.003 1.00 0.00 N HETATM 3 C2 UNL 1 -4.104 0.672 -0.789 1.00 0.00 C HETATM 4 C3 UNL 1 -1.799 0.362 -0.888 1.00 0.00 C HETATM 5 C4 UNL 1 -0.478 0.272 -0.260 1.00 0.00 C HETATM 6 C5 UNL 1 -0.305 0.490 1.088 1.00 0.00 C HETATM 7 C6 UNL 1 0.949 0.403 1.688 1.00 0.00 C HETATM 8 C7 UNL 1 2.031 0.090 0.896 1.00 0.00 C HETATM 9 C8 UNL 1 3.317 -0.014 1.426 1.00 0.00 C HETATM 10 CL1 UNL 1 3.549 0.258 3.128 1.00 0.00 CL HETATM 11 C9 UNL 1 4.388 -0.328 0.617 1.00 0.00 C HETATM 12 C10 UNL 1 4.213 -0.545 -0.732 1.00 0.00 C HETATM 13 CL2 UNL 1 5.514 -0.945 -1.818 1.00 0.00 CL HETATM 14 C11 UNL 1 2.939 -0.442 -1.257 1.00 0.00 C HETATM 15 O1 UNL 1 2.729 -0.653 -2.607 1.00 0.00 O HETATM 16 C12 UNL 1 1.853 -0.127 -0.454 1.00 0.00 C HETATM 17 N2 UNL 1 0.607 -0.029 -0.990 1.00 0.00 N HETATM 18 H1 UNL 1 -3.328 -0.138 1.984 1.00 0.00 H HETATM 19 H2 UNL 1 -2.244 -1.232 0.977 1.00 0.00 H HETATM 20 H3 UNL 1 -3.984 -1.141 0.684 1.00 0.00 H HETATM 21 H4 UNL 1 -4.961 0.155 -0.277 1.00 0.00 H HETATM 22 H5 UNL 1 -3.961 0.149 -1.754 1.00 0.00 H HETATM 23 H6 UNL 1 -4.356 1.730 -1.001 1.00 0.00 H HETATM 24 H7 UNL 1 -1.984 -0.550 -1.526 1.00 0.00 H HETATM 25 H8 UNL 1 -1.781 1.208 -1.599 1.00 0.00 H HETATM 26 H9 UNL 1 -1.112 0.735 1.740 1.00 0.00 H HETATM 27 H10 UNL 1 1.102 0.570 2.742 1.00 0.00 H HETATM 28 H11 UNL 1 5.401 -0.418 0.992 1.00 0.00 H HETATM 29 H12 UNL 1 1.793 -0.573 -2.967 1.00 0.00 H CONECT 1 2 18 19 20 CONECT 2 3 4 CONECT 3 21 22 23 CONECT 4 5 24 25 CONECT 5 6 6 17 CONECT 6 7 26 CONECT 7 8 8 27 CONECT 8 9 16 CONECT 9 10 11 11 CONECT 11 12 28 CONECT 12 13 14 14 CONECT 14 15 16 CONECT 15 29 CONECT 16 17 17 END