HMDB0059835 RDKit 3D Nonanal 28 27 0 0 0 0 0 0 0 0999 V2000 -3.3323 -0.3692 -0.5957 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0176 -0.9993 -0.2189 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4135 -0.3842 1.0259 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1376 1.0586 0.9047 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2553 1.5646 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1534 1.1783 -0.2467 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5259 -0.2386 -0.4582 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0751 -0.2544 -0.5544 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5503 -1.6296 -0.7665 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7878 -2.5712 -0.8458 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6281 0.4106 0.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1242 -1.1316 -0.7519 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2217 0.1587 -1.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2078 -2.0778 -0.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3225 -0.9519 -1.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6525 -1.0199 1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2703 -0.4585 1.8035 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6497 1.3633 1.8957 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1241 1.6029 0.9359 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2596 2.7062 -0.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7031 1.4372 -1.1891 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6852 1.5694 0.6856 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6195 1.8322 -1.0532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1781 -0.6817 -1.3895 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2865 -0.8523 0.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4102 0.3710 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4377 0.1916 0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6101 -1.8245 -0.8569 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 2 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 6 22 1 0 6 23 1 0 7 24 1 0 7 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 M END