HMDB0033167 RDKit 3D Ethyl cyclohexanecarboxylate 27 27 0 0 0 0 0 0 0 0999 V2000 3.8729 -0.2853 -0.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2093 -1.1685 0.7683 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8028 -1.1817 0.6561 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0294 -0.0418 0.7926 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6526 1.0346 1.0273 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -0.0606 0.6735 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0452 1.3088 0.8637 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2356 1.5443 -0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1097 0.3225 -0.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3482 -0.9036 -0.5976 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8683 -0.5695 -0.6723 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2176 -0.1677 -1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 0.6978 0.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8454 -0.7463 -0.5148 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5456 -2.2289 0.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -0.9124 1.8015 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8646 -0.7262 1.4563 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2407 2.0434 0.6111 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3002 1.4870 1.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 2.3325 0.4443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8598 1.8854 -1.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8529 0.5429 -0.9658 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5987 0.1271 0.7934 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4298 -1.7130 0.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6896 -1.3244 -1.5477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7311 0.2096 -1.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3172 -1.5060 -0.9240 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 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 6 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 6 17 1 0 7 18 1 0 7 19 1 0 8 20 1 0 8 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 11 26 1 0 11 27 1 0 M END