CTB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 23 23 0 0 0 0 0 0 0 0999 V2000 -3.6831 0.5225 0.4287 B 0 0 0 0 0 -4.7924 0.9869 1.1831 O 0 0 0 0 0 -3.2594 1.2347 -0.7231 O 0 0 0 0 0 -2.9252 -0.7798 0.8691 C 0 0 0 0 0 -1.8282 -1.0453 -0.0646 N 0 0 0 0 0 -0.6060 -0.5270 0.1660 C 0 0 0 0 0 -0.4137 0.1600 1.1468 O 0 0 0 0 0 0.5208 -0.8009 -0.7948 C 0 0 0 0 0 1.7718 -0.1118 -0.3113 C 0 0 0 0 0 2.7369 -0.5786 0.5175 C 0 0 0 0 0 3.8087 0.2376 0.8239 C 0 0 0 0 0 3.8576 1.4840 0.2957 C 0 0 0 0 0 2.3604 1.5326 -0.6745 S 0 0 0 0 0 -5.1089 1.7910 0.7483 H 0 0 0 0 0 -3.8507 1.9944 -0.8153 H 0 0 0 0 0 -2.5225 -0.6446 1.8724 H 0 0 0 0 0 -3.6182 -1.6209 0.8658 H 0 0 0 0 0 -1.9817 -1.5949 -0.8492 H 0 0 0 0 0 0.6978 -1.8753 -0.8511 H 0 0 0 0 0 0.2573 -0.4234 -1.7822 H 0 0 0 0 0 2.6739 -1.5773 0.9249 H 0 0 0 0 0 4.5942 -0.1118 1.4783 H 0 0 0 0 0 4.6078 2.2497 0.4287 H 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 14 1 0 0 0 3 15 1 0 0 0 4 5 1 0 0 0 4 16 1 0 0 0 4 17 1 0 0 0 5 6 1 0 0 0 5 18 1 0 0 0 6 7 2 0 0 0 6 8 1 0 0 0 8 9 1 0 0 0 8 19 1 0 0 0 8 20 1 0 0 0 9 10 2 0 0 0 9 13 1 0 0 0 10 11 1 0 0 0 10 21 1 0 0 0 11 12 2 0 0 0 11 22 1 0 0 0 12 13 1 0 0 0 12 23 1 0 0 0 M END $$$$