HMDB0031440 RDKit 3D Linalool oxide (trans-pyranoid) 30 30 0 0 0 0 0 0 0 0999 V2000 3.0722 0.1734 0.6476 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8189 -0.1912 0.8624 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9893 -0.5665 -0.3088 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7616 -1.6450 -1.0566 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8613 0.6508 -1.1879 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1826 1.6159 -0.7242 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9419 1.1242 0.4782 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1942 1.7830 0.4506 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2037 -0.3322 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6694 -0.8023 1.8162 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4041 -0.5713 -0.4918 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2074 -1.1385 0.0323 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7411 0.4639 1.4732 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 0.2127 -0.3349 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4528 -0.2010 1.8715 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0912 -1.9648 -1.9004 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7214 -1.3049 -1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8414 -2.5199 -0.3509 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6217 0.3313 -2.2098 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8368 1.1681 -1.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2806 2.6093 -0.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9122 1.8565 -1.5396 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4576 1.4635 1.4125 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1572 2.6356 -0.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -1.8548 1.6695 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 -0.8454 2.4547 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4268 -0.1503 2.2446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 0.0793 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3427 -1.6257 -0.8598 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3539 -0.4537 0.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 3 2 1 1 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 9 12 1 0 12 3 1 0 1 13 1 0 1 14 1 0 2 15 1 0 4 16 1 0 4 17 1 0 4 18 1 0 5 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 7 23 1 1 8 24 1 0 10 25 1 0 10 26 1 0 10 27 1 0 11 28 1 0 11 29 1 0 11 30 1 0 M END