HMDB0004472 RDKit 3D Eucalyptol 29 30 0 0 0 0 0 0 0 0999 V2000 1.6649 1.2995 1.2849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1082 0.3888 0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2863 -0.1003 -0.6057 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2612 1.0635 -0.6533 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 0.3933 -0.7070 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9182 1.0549 -1.6743 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5754 0.5035 0.6714 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8193 -0.4257 1.5788 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4774 -0.7858 0.8863 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0953 -1.8134 -0.1858 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -1.0433 -1.1528 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7955 0.7604 2.2464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0487 2.1901 1.4501 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6906 1.6586 1.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6155 -1.1064 -0.3617 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0367 -0.0914 -1.7053 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1628 0.5917 -0.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3624 1.9555 -1.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7757 0.3352 -1.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4753 1.2352 -2.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3412 1.5480 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6569 0.3854 0.6935 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6908 -0.0653 2.5973 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4327 -1.3695 1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1776 -1.1886 1.6177 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4928 -2.6012 0.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9594 -2.2574 -0.6697 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7919 -1.4906 -1.2448 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2764 -1.0247 -2.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 6 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 9 2 1 0 11 5 1 0 1 12 1 0 1 13 1 0 1 14 1 0 3 15 1 0 3 16 1 0 3 17 1 0 6 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 8 23 1 0 8 24 1 0 9 25 1 1 10 26 1 0 10 27 1 0 11 28 1 0 11 29 1 0 M END