CTK Converted by convert_cif2sdf.py 2024/03/29 11:09:15 30 30 0 0 0 0 0 0 0 0999 V2000 -5.1714 0.4956 -0.8610 C 0 0 0 0 0 2.2968 0.0373 -0.1843 C 0 0 0 0 0 1.7032 1.2935 -0.1131 C 0 0 0 0 0 3.6888 -0.0502 -0.2340 C 0 0 0 0 0 4.4281 1.1394 -0.2156 C 0 0 0 0 0 3.7609 2.3449 -0.1487 C 0 0 0 0 0 4.3659 -1.3643 -0.3047 C 0 0 0 0 0 -0.5087 0.1883 -0.0746 C 0 0 0 0 0 -1.9862 0.5797 -0.0048 C 0 0 0 0 0 2.4428 2.3901 -0.0980 N 0 0 0 0 0 0.3179 1.3982 -0.0579 N 0 0 0 0 0 -2.8128 -0.6302 -0.0216 N 0 0 0 0 0 -4.3974 0.1222 1.6654 O 0 0 0 0 0 3.7087 -2.3857 -0.3191 O 0 0 0 0 0 5.7101 -1.4286 -0.3512 O 0 0 0 0 0 -4.8711 -1.8870 0.3023 O 0 0 0 0 0 -4.4083 -0.5481 0.4121 S 0 0 0 0 0 -6.2350 0.6047 -0.6522 H 0 0 0 0 0 -4.6980 1.4771 -0.8577 H 0 0 0 0 0 -5.0379 0.0316 -1.8386 H 0 0 0 0 0 1.6902 -0.8561 -0.1957 H 0 0 0 0 0 5.5067 1.1131 -0.2528 H 0 0 0 0 0 4.3256 3.2657 -0.1345 H 0 0 0 0 0 -0.2568 -0.4354 0.7826 H 0 0 0 0 0 -0.3228 -0.3660 -0.9948 H 0 0 0 0 0 -2.1720 1.1340 0.9153 H 0 0 0 0 0 -2.2380 1.2035 -0.8620 H 0 0 0 0 0 -0.1010 2.2709 -0.0078 H 0 0 0 0 0 -2.4258 -1.4781 -0.2869 H 0 0 0 0 0 6.1066 -2.3091 -0.3968 H 0 0 0 0 0 16 17 2 0 0 0 6 5 2 0 0 0 6 10 1 0 0 0 5 4 1 0 0 0 10 3 2 0 0 0 14 7 2 0 0 0 4 7 1 0 0 0 4 2 2 0 0 0 7 15 1 0 0 0 3 2 1 0 0 0 3 11 1 0 0 0 9 12 1 0 0 0 9 8 1 0 0 0 17 1 1 0 0 0 17 13 2 0 0 0 17 12 1 0 0 0 11 8 1 0 0 0 1 18 1 0 0 0 1 19 1 0 0 0 1 20 1 0 0 0 2 21 1 0 0 0 5 22 1 0 0 0 6 23 1 0 0 0 8 24 1 0 0 0 8 25 1 0 0 0 9 26 1 0 0 0 9 27 1 0 0 0 11 28 1 0 0 0 12 29 1 0 0 0 15 30 1 0 0 0 M END $$$$