HMDB0029943 RDKit 3D Arbutin 35 36 0 0 0 0 0 0 0 0999 V2000 -4.3947 -1.6621 0.5452 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0263 -1.8044 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3396 -0.5350 1.0596 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0217 -0.7324 1.0152 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2325 -0.0489 0.1404 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8319 -0.8009 -0.3435 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1749 -0.5972 -0.2413 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0896 -1.4959 -0.8133 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4505 -1.3293 -0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9713 -0.2396 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 -0.0641 0.0142 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0937 0.6548 0.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7035 0.4835 0.4176 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0391 0.5648 -1.0163 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1693 1.2127 -1.8758 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9632 1.5438 -0.3066 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6038 2.3867 -1.1973 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9296 0.6653 0.4494 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6197 1.4714 1.3658 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7502 -1.8687 1.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7521 -2.6362 1.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6512 -2.0860 -0.4577 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6454 -0.5314 2.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1546 0.8349 0.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6575 -2.3426 -1.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1143 -2.0641 -1.2006 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7534 0.7242 0.4946 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4779 1.5303 1.0334 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0706 1.2221 0.8856 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6198 -0.2129 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1186 0.8045 -2.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3968 2.1220 0.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 3.3258 -0.9932 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7091 0.3560 -0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5521 1.1489 1.4954 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 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 2 0 5 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 3 1 0 13 7 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 1 5 24 1 1 8 25 1 0 9 26 1 0 11 27 1 0 12 28 1 0 13 29 1 0 14 30 1 6 15 31 1 0 16 32 1 1 17 33 1 0 18 34 1 6 19 35 1 0 M END