COMPND HMDB0303846 HETATM 1 C1 UNL 1 2.972 -0.245 0.271 1.00 0.00 C HETATM 2 C2 UNL 1 1.829 0.539 0.799 1.00 0.00 C HETATM 3 O1 UNL 1 2.060 1.445 1.629 1.00 0.00 O HETATM 4 C3 UNL 1 0.457 0.297 0.392 1.00 0.00 C HETATM 5 C4 UNL 1 0.250 -0.680 -0.498 1.00 0.00 C HETATM 6 C5 UNL 1 -1.131 -0.961 -0.941 1.00 0.00 C HETATM 7 C6 UNL 1 -2.115 0.081 -0.573 1.00 0.00 C HETATM 8 C7 UNL 1 -1.917 0.500 0.885 1.00 0.00 C HETATM 9 N1 UNL 1 -0.593 1.085 0.936 1.00 0.00 N HETATM 10 H1 UNL 1 3.922 0.004 0.765 1.00 0.00 H HETATM 11 H2 UNL 1 3.096 0.007 -0.804 1.00 0.00 H HETATM 12 H3 UNL 1 2.705 -1.317 0.390 1.00 0.00 H HETATM 13 H4 UNL 1 1.105 -1.240 -0.872 1.00 0.00 H HETATM 14 H5 UNL 1 -1.451 -1.990 -0.634 1.00 0.00 H HETATM 15 H6 UNL 1 -1.092 -1.012 -2.065 1.00 0.00 H HETATM 16 H7 UNL 1 -3.148 -0.307 -0.631 1.00 0.00 H HETATM 17 H8 UNL 1 -1.968 0.999 -1.178 1.00 0.00 H HETATM 18 H9 UNL 1 -2.705 1.188 1.215 1.00 0.00 H HETATM 19 H10 UNL 1 -1.929 -0.402 1.531 1.00 0.00 H HETATM 20 H11 UNL 1 -0.346 2.010 1.325 1.00 0.00 H CONECT 1 2 10 11 12 CONECT 2 3 3 4 CONECT 4 5 5 9 CONECT 5 6 13 CONECT 6 7 14 15 CONECT 7 8 16 17 CONECT 8 9 18 19 CONECT 9 20 END