HMDB0256905 RDKit 3D 3-{[(1s)-2,2-Difluoro-1-Hydroxy-7-(Methylsulfonyl)-2,3-Dihydro-1h-Inden-4-Yl]... 38 40 0 0 0 0 0 0 0 0999 V2000 -3.0153 3.3982 0.6324 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4228 1.7086 0.3822 S 0 0 0 0 0 6 0 0 0 0 0 0 -4.2761 1.6252 -0.8739 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2502 1.2396 1.5305 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0072 0.7551 0.1167 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7904 1.4083 0.1334 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4261 0.7545 -0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3784 -0.5884 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5648 -1.2777 -0.4913 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7881 -0.6278 -0.4756 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3187 -0.1048 -1.6344 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5525 0.5536 -1.6325 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 1.0586 -2.7848 F 0 0 0 0 0 0 0 0 0 0 0 0 5.2547 0.6885 -0.4724 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7417 0.1712 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 0.3121 1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0646 0.4384 2.9239 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5108 -0.4829 0.6899 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8386 -1.2561 -0.3061 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -0.6030 -0.1074 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1102 -1.5706 -0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2125 -1.1098 -0.9336 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5199 -2.7141 -0.9827 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -2.3707 -2.3178 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.1382 -3.9161 -0.7008 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0788 -2.7114 -0.5312 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9109 3.9940 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5825 3.8775 -0.2758 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2804 3.5541 1.4439 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7485 2.4884 0.3098 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3458 1.3332 -0.0405 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7473 -0.2239 -2.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2098 1.1968 -0.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1588 -0.8636 1.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -1.9140 0.7958 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8614 -1.8623 -0.9331 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9517 -3.3148 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4515 -3.0438 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 2 0 2 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 1 0 16 17 3 0 15 18 2 0 8 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 20 5 1 0 18 10 1 0 26 19 1 0 1 27 1 0 1 28 1 0 1 29 1 0 6 30 1 0 7 31 1 0 11 32 1 0 14 33 1 0 18 34 1 0 21 35 1 0 22 36 1 0 26 37 1 0 26 38 1 0 M END