HMDB0031176 RDKit 3D Tetrahydrofurfuryl acetate 22 22 0 0 0 0 0 0 0 0999 V2000 3.6221 0.8114 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -0.0412 0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -1.0673 -0.6973 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2828 0.2058 0.7796 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1286 -0.5876 0.7961 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.7201 -0.5478 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1676 0.6173 -0.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3133 0.6529 0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -0.8027 0.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -1.5277 -0.3889 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4193 1.8515 0.2742 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3073 0.3650 0.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1454 0.7778 -0.9399 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 -0.0952 1.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2926 -1.6069 1.1851 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1217 -1.0877 -1.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5001 1.4644 -0.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 0.5682 -1.8987 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2208 1.0930 -0.3217 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0483 1.2554 0.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5691 -1.0812 0.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4013 -1.0453 1.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 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 6 1 0 1 11 1 0 1 12 1 0 1 13 1 0 5 14 1 0 5 15 1 0 6 16 1 0 7 17 1 0 7 18 1 0 8 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 M END