HMDB0059708 RDKit 3D 2-Ethylsuberic acid 32 31 0 0 0 0 0 0 0 0999 V2000 -3.3213 -0.4259 -1.4571 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9457 0.6603 -0.4953 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4967 0.1582 0.8404 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2813 -0.7334 0.7307 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1049 -0.0076 0.1154 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1047 -0.9143 0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2405 -0.1102 -0.6128 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4883 -0.9534 -0.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 -0.1505 -1.3565 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7173 -0.6251 -1.5747 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3573 1.1724 -1.7126 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1841 1.3345 1.6914 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3121 2.5054 1.2575 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7404 1.1621 2.9951 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6412 -1.3604 -0.9563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1352 -0.0155 -2.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4486 -0.6126 -2.1166 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1244 1.2701 -0.9192 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7855 1.3837 -0.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2954 -0.4762 1.3293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5476 -1.5584 0.0353 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9985 -1.1786 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2052 0.8783 0.6911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3212 0.3280 -0.9178 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4505 -1.1994 1.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8209 -1.7699 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 0.8039 -0.0321 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9531 0.2117 -1.6372 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2834 -1.8030 -1.4386 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8625 -1.3083 0.2341 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 1.8640 -1.0569 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 1.4703 3.2709 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 9 11 1 0 3 12 1 0 12 13 2 0 12 14 1 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 4 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 8 29 1 0 8 30 1 0 11 31 1 0 14 32 1 0 M END