CFK Converted by convert_cif2sdf.py 2024/03/29 11:09:15 29 30 0 0 0 0 0 0 0 0999 V2000 4.5727 0.5277 0.0088 C 0 0 0 0 0 4.1180 -0.7793 0.0405 C 0 0 0 0 0 2.7643 -1.0428 0.0329 C 0 0 0 0 0 1.8509 0.0124 -0.0062 C 0 0 0 0 0 2.3164 1.3286 -0.0388 C 0 0 0 0 0 3.6724 1.5781 -0.0303 C 0 0 0 0 0 0.3994 -0.2622 -0.0159 C 0 0 0 0 0 -0.5758 0.6876 -0.0534 C 0 0 0 0 0 -1.8607 0.1955 -0.0546 C 0 0 0 0 0 -1.9429 -1.1756 -0.0180 C 0 0 0 0 0 -0.3251 -1.8639 0.0137 S 0 0 0 0 0 -3.1475 -1.9202 -0.0119 C 0 0 0 0 0 -4.2199 -1.3445 -0.0407 O 0 0 0 0 0 -3.1062 -3.2667 0.0258 N 0 0 0 0 0 -2.9863 1.0201 -0.0906 N 0 0 0 0 0 -2.8464 2.3560 0.0207 C 0 0 0 0 0 -1.7366 2.8504 0.0589 O 0 0 0 0 0 -3.9383 3.1440 0.0906 N 0 0 0 0 0 5.6337 0.7280 0.0200 H 0 0 0 0 0 4.8253 -1.5947 0.0713 H 0 0 0 0 0 2.4106 -2.0625 0.0575 H 0 0 0 0 0 1.6150 2.1491 -0.0696 H 0 0 0 0 0 4.0341 2.5950 -0.0549 H 0 0 0 0 0 -0.3580 1.7455 -0.0789 H 0 0 0 0 0 -2.2524 -3.7259 0.0478 H 0 0 0 0 0 -3.9307 -3.7772 0.0298 H 0 0 0 0 0 -3.8693 0.6318 -0.1963 H 0 0 0 0 0 -4.8242 2.7494 0.0599 H 0 0 0 0 0 -3.8375 4.1061 0.1707 H 0 0 0 0 0 1 2 2 0 0 0 1 6 1 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 4 7 1 0 0 0 5 6 2 0 0 0 7 8 2 0 0 0 7 11 1 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 9 15 1 0 0 0 10 11 1 0 0 0 10 12 1 0 0 0 12 13 2 0 0 0 12 14 1 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 16 18 1 0 0 0 1 19 1 0 0 0 2 20 1 0 0 0 3 21 1 0 0 0 5 22 1 0 0 0 6 23 1 0 0 0 8 24 1 0 0 0 14 25 1 0 0 0 14 26 1 0 0 0 15 27 1 0 0 0 18 28 1 0 0 0 18 29 1 0 0 0 M END $$$$