HMDB0033848 RDKit 3D Methyl decanoate 35 34 0 0 0 0 0 0 0 0999 V2000 -3.6754 1.6589 0.5019 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7729 0.9251 -0.7804 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4902 -0.5232 -0.7786 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1475 -1.0087 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6469 -0.6913 0.9546 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2695 -1.2913 1.2161 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7612 -0.7744 0.2361 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0666 -1.4357 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2265 -1.0662 -0.2493 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 0.3545 -0.2125 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 1.1804 0.4763 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5989 0.8197 -0.9961 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9385 2.1999 -0.9816 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7843 2.3238 0.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5588 2.3759 0.5353 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8261 1.0523 1.4185 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 1.4044 -1.4886 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8111 1.0528 -1.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -1.0073 -0.1108 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7916 -0.9002 -1.8143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4275 -0.6189 -1.1863 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1473 -2.1217 -0.5239 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3202 -1.1263 1.7145 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6172 0.4053 1.1118 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 -0.9660 2.2348 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3533 -2.3712 1.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5105 -1.1037 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8367 0.3107 0.2659 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3113 -1.1174 1.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9343 -2.5378 0.6695 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1543 -1.4481 -1.2904 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 -1.6089 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3289 2.4560 -1.9733 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9871 2.7515 -0.7587 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 2.4471 -0.1664 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 2 0 10 12 1 0 12 13 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 7 28 1 0 8 29 1 0 8 30 1 0 9 31 1 0 9 32 1 0 13 33 1 0 13 34 1 0 13 35 1 0 M END