HMDB0031409 RDKit 3D 2-Decanone 31 30 0 0 0 0 0 0 0 0999 V2000 -4.4993 1.1672 0.6892 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8589 -0.0646 0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3616 0.2542 -0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5985 -0.8781 -0.6044 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1414 -0.5057 -0.7015 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3954 -0.2149 0.6461 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8512 0.1563 0.5632 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6972 -0.9241 -0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1375 -0.5448 -0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6281 0.7625 0.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9229 -1.3487 -0.5234 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7596 1.8321 1.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2410 0.8815 1.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9855 1.7664 -0.1217 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2699 -0.3130 -0.9144 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0032 -0.9617 0.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2502 1.1556 -0.6205 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 0.4412 1.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9276 -1.1323 -1.6351 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -1.8173 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0151 0.4035 -1.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4485 -1.3427 -1.1397 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2248 -1.1090 1.2841 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.6271 1.1844 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2229 0.4517 1.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8945 1.0497 -0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4165 -1.1816 -1.0617 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5397 -1.8556 0.5749 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3641 1.1331 -0.3523 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2283 0.6650 1.3524 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7822 1.4471 0.5298 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 9 11 2 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 5 22 1 0 6 23 1 0 6 24 1 0 7 25 1 0 7 26 1 0 8 27 1 0 8 28 1 0 10 29 1 0 10 30 1 0 10 31 1 0 M END