HMDB0030928 RDKit 3D Tridecanal 40 39 0 0 0 0 0 0 0 0999 V2000 6.1727 0.5298 0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6305 -0.8837 0.0368 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1968 -0.8423 -0.4102 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 0.0293 0.4877 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9301 -0.0268 -0.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 0.7881 0.6958 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3978 0.6933 0.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8956 -0.7111 0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2771 -0.8145 -0.5764 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3059 0.0039 0.1836 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6617 -0.1369 -0.4755 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6886 0.6745 0.2755 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0015 0.5125 -0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1129 -0.1854 -1.3864 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2806 0.4875 0.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 0.9552 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7462 1.0943 0.8381 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6766 -1.3149 1.0549 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 -1.5217 -0.6822 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1954 -0.3701 -1.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7449 -1.8359 -0.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2819 -0.4730 1.4881 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 1.0481 0.5374 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9978 0.4262 -1.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7071 -1.0860 -0.2012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9169 0.5107 1.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2906 1.8572 0.6101 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1095 1.3137 0.6555 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4099 1.1060 -0.9624 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2478 -1.4087 -0.5075 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0302 -1.0322 1.1164 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6276 -1.8668 -0.5285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2351 -0.5232 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -0.2100 1.2526 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 1.0840 0.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5728 0.2426 -1.5011 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9329 -1.1906 -0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4049 1.7504 0.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7357 0.3220 1.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8907 1.0047 -0.0337 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 2 0 1 15 1 0 1 16 1 0 1 17 1 0 2 18 1 0 2 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 7 29 1 0 8 30 1 0 8 31 1 0 9 32 1 0 9 33 1 0 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 13 40 1 0 M END