HMDB0060482 RDKit 3D Hexadecenal 47 46 0 0 0 0 0 0 0 0999 V2000 6.4416 -1.6066 -0.2738 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 -2.0544 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1745 -0.7661 0.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7711 -1.1473 0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 0.1144 0.4903 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8807 0.9413 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1715 2.2310 -0.7537 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2599 2.3640 -0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6407 2.1006 0.9431 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1459 2.2544 1.1767 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9387 1.3127 0.3307 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -0.1129 0.6253 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3435 -1.1048 -0.1858 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8045 -1.0310 0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4450 -2.0972 0.4601 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8841 -2.0392 0.6514 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5215 -0.9991 0.3911 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -2.2849 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5888 -0.6135 0.1519 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6177 -1.5530 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6175 -2.7262 -0.7582 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0389 -2.5468 1.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6082 -0.1218 0.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2519 -0.3025 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3028 -1.7878 -0.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7402 -1.6219 1.3864 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8783 -0.3602 0.6308 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2486 0.6487 1.3817 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5561 0.2700 -1.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9793 1.1314 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4344 2.7769 -1.7379 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7215 2.9185 0.0041 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8222 1.6059 -1.1094 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 3.3826 -0.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 1.2126 1.3682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2123 2.9515 1.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3184 1.9845 2.2381 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4297 3.2969 1.0376 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8443 1.5355 -0.7582 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0073 1.4599 0.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8102 -0.2921 1.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.2414 0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1544 -0.8743 -1.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9384 -2.1112 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -0.1579 -0.2068 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9127 -3.0174 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3790 -2.9219 1.0243 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 6 29 1 0 6 30 1 0 7 31 1 0 7 32 1 0 8 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 10 37 1 0 10 38 1 0 11 39 1 0 11 40 1 0 12 41 1 0 12 42 1 0 13 43 1 0 13 44 1 0 14 45 1 0 15 46 1 0 16 47 1 0 M END