9E5 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 46 48 0 0 0 0 0 0 0 0999 V2000 -4.4160 0.8657 -0.0049 C 0 0 0 0 0 -3.0193 0.9093 -0.0045 C 0 0 0 0 0 -2.0329 1.9884 -0.0068 C 0 0 0 0 0 -2.1752 -2.7947 0.0048 C 0 0 0 0 0 -0.8161 1.3861 -0.0049 C 0 0 0 0 0 -2.2761 -0.2859 -0.0013 C 0 0 0 0 0 -2.9498 -1.5020 0.0014 C 0 0 0 0 0 0.4748 2.0884 -0.0061 C 0 0 0 0 0 -5.0554 -0.3415 0.0039 C 0 0 0 0 0 7.3337 -2.6248 -1.2404 O 0 0 0 0 0 7.3984 -1.9498 0.0080 S 0 0 0 0 0 7.3318 -2.6197 1.2586 O 0 0 0 0 0 8.8202 -1.1002 0.0074 N 0 0 0 0 0 6.0879 -0.7718 0.0037 C 0 0 0 0 0 5.5736 -0.3127 -1.1946 C 0 0 0 0 0 4.5463 0.6119 -1.1972 C 0 0 0 0 0 5.5682 -0.3114 1.1994 C 0 0 0 0 0 4.5410 0.6133 1.1968 C 0 0 0 0 0 4.0323 1.0767 -0.0015 C 0 0 0 0 0 2.9115 2.0853 -0.0043 C 0 0 0 0 0 1.6249 1.3855 -0.0041 N 0 0 0 0 0 0.5059 3.3047 -0.0091 O 0 0 0 0 0 -2.3109 3.4702 -0.0114 C 0 0 0 0 0 -0.9711 0.0460 -0.0017 O 0 0 0 0 0 -4.3277 -1.5237 0.0020 C 0 0 0 0 0 -5.0527 -2.8454 0.0049 C 0 0 0 0 0 -4.9869 1.7818 -0.0073 H 0 0 0 0 0 -1.9879 -3.1033 1.0336 H 0 0 0 0 0 -2.7508 -3.5657 -0.5066 H 0 0 0 0 0 -1.2253 -2.6503 -0.5093 H 0 0 0 0 0 -6.1357 -0.3765 0.0046 H 0 0 0 0 0 9.4526 -1.2136 -0.7201 H 0 0 0 0 0 9.0205 -0.4893 0.7330 H 0 0 0 0 0 5.9761 -0.6755 -2.1286 H 0 0 0 0 0 4.1456 0.9711 -2.1332 H 0 0 0 0 0 5.9665 -0.6743 2.1364 H 0 0 0 0 0 4.1361 0.9733 2.1318 H 0 0 0 0 0 2.9847 2.7122 0.8842 H 0 0 0 0 0 2.9863 2.7078 -0.8958 H 0 0 0 0 0 1.5999 0.4153 -0.0017 H 0 0 0 0 0 -2.3784 3.8295 1.0157 H 0 0 0 0 0 -1.5035 3.9897 -0.5264 H 0 0 0 0 0 -3.2523 3.6618 -0.5262 H 0 0 0 0 0 -5.2280 -3.1611 1.0336 H 0 0 0 0 0 -6.0072 -2.7369 -0.5087 H 0 0 0 0 0 -4.4467 -3.5928 -0.5061 H 0 0 0 0 0 26 25 1 0 0 0 4 7 1 0 0 0 25 7 2 0 0 0 25 9 1 0 0 0 7 6 1 0 0 0 9 1 2 0 0 0 6 24 1 0 0 0 6 2 2 0 0 0 24 5 1 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 21 20 1 0 0 0 21 8 1 0 0 0 5 3 2 0 0 0 5 8 1 0 0 0 20 19 1 0 0 0 3 23 1 0 0 0 8 22 2 0 0 0 19 16 2 0 0 0 19 18 1 0 0 0 16 15 1 0 0 0 18 17 2 0 0 0 15 14 2 0 0 0 17 14 1 0 0 0 14 11 1 0 0 0 13 11 1 0 0 0 10 11 2 0 0 0 11 12 2 0 0 0 1 27 1 0 0 0 4 28 1 0 0 0 4 29 1 0 0 0 4 30 1 0 0 0 9 31 1 0 0 0 13 32 1 0 0 0 13 33 1 0 0 0 15 34 1 0 0 0 16 35 1 0 0 0 17 36 1 0 0 0 18 37 1 0 0 0 20 38 1 0 0 0 20 39 1 0 0 0 21 40 1 0 0 0 23 41 1 0 0 0 23 42 1 0 0 0 23 43 1 0 0 0 26 44 1 0 0 0 26 45 1 0 0 0 26 46 1 0 0 0 M END $$$$