90J Converted by convert_cif2sdf.py 2024/03/29 11:09:15 27 28 0 0 0 0 0 0 0 0999 V2000 -0.6366 2.6893 -0.2844 C 0 0 0 0 0 -0.3375 1.3658 -0.1468 C 0 0 0 0 0 1.0689 1.2530 -0.0761 C 0 0 0 0 0 -1.3127 0.2480 -0.0841 C 0 0 0 0 0 -2.3943 0.3125 0.7921 C 0 0 0 0 0 -3.2976 -0.7285 0.8470 C 0 0 0 0 0 -3.1309 -1.8374 0.0336 C 0 0 0 0 0 -2.0568 -1.9059 -0.8386 C 0 0 0 0 0 -1.1510 -0.8671 -0.9034 C 0 0 0 0 0 3.7237 1.1565 0.0468 O 0 0 0 0 0 5.6942 -0.8105 0.3161 S 0 0 0 0 0 -4.0176 -2.8552 0.0918 F 0 0 0 0 0 0.5257 3.3726 -0.3042 N 0 0 0 0 0 1.5770 2.4575 -0.1676 N 0 0 0 0 0 3.9204 -1.1844 0.2748 C 0 0 0 0 0 3.1402 0.0963 0.1210 C 0 0 0 0 0 1.7942 0.0634 0.0663 N 0 0 0 0 0 -1.6266 3.1130 -0.3664 H 0 0 0 0 0 -2.5252 1.1771 1.4260 H 0 0 0 0 0 -4.1366 -0.6796 1.5262 H 0 0 0 0 0 -1.9296 -2.7730 -1.4705 H 0 0 0 0 0 -0.3164 -0.9198 -1.5865 H 0 0 0 0 0 6.2563 -2.0242 0.4538 H 0 0 0 0 0 0.6178 4.3338 -0.3923 H 0 0 0 0 0 3.7066 -1.8421 -0.5667 H 0 0 0 0 0 3.6305 -1.6759 1.2033 H 0 0 0 0 0 1.3271 -0.7853 0.1267 H 0 0 0 0 0 11 15 1 0 0 0 14 13 1 0 0 0 14 3 2 0 0 0 17 3 1 0 0 0 17 16 1 0 0 0 15 16 1 0 0 0 13 1 1 0 0 0 3 2 1 0 0 0 16 10 2 0 0 0 1 2 2 0 0 0 2 4 1 0 0 0 9 4 2 0 0 0 9 8 1 0 0 0 4 5 1 0 0 0 8 7 2 0 0 0 5 6 2 0 0 0 7 6 1 0 0 0 7 12 1 0 0 0 1 18 1 0 0 0 5 19 1 0 0 0 6 20 1 0 0 0 8 21 1 0 0 0 9 22 1 0 0 0 11 23 1 0 0 0 13 24 1 0 0 0 15 25 1 0 0 0 15 26 1 0 0 0 17 27 1 0 0 0 M END $$$$