HMDB0014743 RDKit 3D Sulindac 42 44 0 0 0 0 0 0 0 0999 V2000 2.4392 -2.8831 0.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1689 -1.4523 -0.0669 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -0.5279 -0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5716 -0.8315 -0.3256 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2714 -0.2445 0.8254 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 0.8464 0.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2835 -0.9291 2.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5094 0.7808 -0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0386 2.0422 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2082 3.1429 -0.5907 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7393 4.3857 -0.7787 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8552 2.9520 -0.4566 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2732 1.6964 -0.2686 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1215 0.6212 -0.2217 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8525 -0.7769 -0.0411 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2806 -1.3905 0.1435 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -0.7299 0.1568 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1646 -0.3281 -0.9954 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4135 0.2926 -0.9339 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0322 0.5069 0.2738 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6296 1.2953 0.3697 S 0 0 0 0 0 4 0 0 0 0 0 0 -6.8944 0.0312 0.2258 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 1.9473 1.7546 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4165 0.1053 1.4467 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1772 -0.5089 1.3591 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1089 -3.2847 -0.7184 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -3.0397 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5188 -3.4845 0.0608 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7462 -1.9304 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9313 -0.4024 -1.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -1.9410 2.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0934 2.2384 -0.6558 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2232 3.8219 -0.5029 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7765 1.6725 -0.1512 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2239 -2.4997 0.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7113 -0.4757 -1.9505 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8905 0.6071 -1.8702 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6736 0.2790 -0.5253 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3650 -0.1236 1.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4212 -0.9582 -0.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9368 0.2916 2.3785 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7214 -0.8139 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 3 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 21 23 2 0 20 24 1 0 24 25 2 0 15 2 1 0 25 17 1 0 14 8 1 0 1 26 1 0 1 27 1 0 1 28 1 0 4 29 1 0 4 30 1 0 7 31 1 0 9 32 1 0 12 33 1 0 13 34 1 0 16 35 1 0 18 36 1 0 19 37 1 0 22 38 1 0 22 39 1 0 22 40 1 0 24 41 1 0 25 42 1 0 M END