HMDB0060545 RDKit 3D O-Desmethylindomethacin 38 40 0 0 0 0 0 0 0 0999 V2000 -1.6364 -2.7257 -0.2385 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3343 -1.2639 -0.2364 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2318 -0.2367 -0.3482 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7063 -0.3045 -0.4955 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3741 -0.6329 0.7879 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6871 -0.8119 1.8227 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7444 -0.7451 0.8615 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4706 0.9205 -0.2939 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8279 2.2589 -0.3547 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8928 3.2614 -0.2772 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3334 4.5699 -0.3459 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4299 2.9083 -0.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8368 1.5931 -0.0701 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1149 0.6005 -0.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0688 -0.7598 -0.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -1.5179 0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -2.7986 0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -1.0558 0.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2694 -0.8222 -1.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -0.4033 -0.8907 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1499 -0.1870 0.3476 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8110 0.3519 0.5226 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.3754 -0.4133 1.4576 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0712 -0.8359 1.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2341 -3.1623 0.6728 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1098 -3.2334 -1.0988 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7038 -2.8996 -0.4112 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1353 0.6548 -0.8474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9537 -1.0714 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1867 -1.6518 0.9926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 2.4602 -0.4663 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7319 5.3742 -0.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 3.6985 -0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8826 1.3697 0.0441 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8321 -0.9836 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1958 -0.2164 -1.7565 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7545 -0.2689 2.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4365 -1.0201 2.2330 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 1 0 16 17 2 0 16 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 2 0 15 2 1 0 24 18 1 0 14 8 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 4 29 1 0 7 30 1 0 9 31 1 0 11 32 1 0 12 33 1 0 13 34 1 0 19 35 1 0 20 36 1 0 23 37 1 0 24 38 1 0 M END