HMDB0252034 RDKit 3D Ethyl 6-chlorochroman-2-carboxylate 29 30 0 0 0 0 0 0 0 0999 V2000 5.0872 -0.0882 -0.6144 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9856 -1.0587 -0.1838 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8342 -0.2839 0.0427 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6163 -0.7799 0.4466 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5062 -2.0133 0.6316 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4386 0.0841 0.6693 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1299 0.7832 -0.6373 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1278 1.5889 -0.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 0.7211 -0.0661 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5618 1.0263 -0.3877 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6132 0.2489 0.0635 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2636 0.6486 -0.3510 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.2756 -0.8342 0.8423 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9897 -1.1682 1.1809 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9367 -0.3694 0.7151 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6368 -0.7294 1.0728 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6298 0.8046 -1.1313 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6673 0.2661 0.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7194 -0.5793 -1.3684 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3533 -1.5734 0.7154 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8394 -1.8334 -0.9715 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6665 0.8825 1.4043 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9683 1.4626 -0.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1045 0.0137 -1.4339 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3506 1.9444 -1.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9826 2.4136 0.1461 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7434 1.9053 -1.0121 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0776 -1.4570 1.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7472 -2.0254 1.7953 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 11 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 6 1 0 15 9 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 2 21 1 0 6 22 1 0 7 23 1 0 7 24 1 0 8 25 1 0 8 26 1 0 10 27 1 0 13 28 1 0 14 29 1 0 M END