HMDB0033716 RDKit 3D 3-Phenylpropanal 20 20 0 0 0 0 0 0 0 0999 V2000 1.8435 0.7466 1.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4923 0.4925 0.4589 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1638 -0.7019 -0.3354 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9592 -0.4980 -1.2283 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2618 -0.1644 -0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1219 -1.1387 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2586 -0.7982 0.6851 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5919 0.5156 0.9605 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7229 1.4827 0.4948 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5804 1.1602 -0.2088 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3009 1.1311 0.1631 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9458 -1.5930 0.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0173 -0.9673 -0.9967 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1891 0.3030 -1.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7813 -1.4415 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8644 -2.1811 -0.2303 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9338 -1.5748 1.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4934 0.7643 1.5156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 2.5258 0.7044 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1067 1.9373 -0.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 5 1 0 2 11 1 0 3 12 1 0 3 13 1 0 4 14 1 0 4 15 1 0 6 16 1 0 7 17 1 0 8 18 1 0 9 19 1 0 10 20 1 0 M END