HMDB0031087 RDKit 3D trans-2-Hexyl-1-cyclopropaneacetic acid 33 33 0 0 0 0 0 0 0 0999 V2000 -4.2834 0.3243 -0.9399 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1685 -0.0514 0.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7389 -0.3043 0.8934 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9226 0.9466 0.6477 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4909 0.7630 1.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2311 -0.3299 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6253 -0.3765 0.8264 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4961 0.8713 0.6958 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8491 -0.4276 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9344 -0.4942 -1.4434 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4051 -0.5232 -1.7948 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9868 0.5182 -2.1773 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.6992 -1.6992 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2712 -0.0147 -1.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4916 -0.1186 -1.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2191 1.4333 -1.0134 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -1.0136 0.6383 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6308 0.7293 1.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3698 -1.1840 0.3267 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6886 -0.5427 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3742 1.7274 1.3223 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0728 1.3216 -0.3849 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0431 1.7450 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4404 0.6015 2.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2923 -1.3061 0.3776 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2843 -0.1283 -0.8044 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6725 -0.8200 1.8673 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1666 1.6578 -0.0053 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0572 1.2267 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7415 -0.9237 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4901 0.3835 -1.9647 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5086 -1.4595 -1.7823 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5641 -2.0361 -0.8388 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 10 11 1 0 11 12 2 0 11 13 1 0 9 7 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 3 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 8 28 1 0 8 29 1 0 9 30 1 0 10 31 1 0 10 32 1 0 13 33 1 0 M END