HMDB0259038 RDKit 3D Thioxanthene 24 26 0 0 0 0 0 0 0 0999 V2000 -3.4831 0.3386 -0.6827 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5383 1.0842 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 1.0479 1.3134 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3378 0.2902 1.0144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2524 -0.4732 -0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3723 -0.4287 -0.9785 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1196 -1.3314 -0.4983 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1666 -0.6512 -0.1844 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2352 -0.7680 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4537 -0.1874 -0.8617 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6726 0.5441 0.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6102 0.6613 1.1916 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4229 0.0774 0.9353 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0771 0.2729 2.0976 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3486 0.3656 -1.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4071 1.6796 0.6764 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5183 1.6570 2.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3981 -0.9961 -1.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -1.5379 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1073 -2.2715 0.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -1.3337 -1.9858 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2769 -0.2867 -1.5766 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6395 0.9943 0.4533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8261 1.2528 2.0968 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 6 1 1 0 13 8 1 0 14 4 1 0 1 15 1 0 2 16 1 0 3 17 1 0 6 18 1 0 7 19 1 0 7 20 1 0 9 21 1 0 10 22 1 0 11 23 1 0 12 24 1 0 M END