040 Converted by convert_cif2sdf.py 2024/03/01 05:07:52 25 25 0 0 0 0 0 0 0 0999 V2000 -1.2082 2.1659 -0.0126 C 0 0 0 0 0 -1.3846 0.6692 0.0070 C 0 0 0 0 0 -0.2655 -0.1682 0.0533 C 0 0 0 0 0 1.0886 0.4073 0.0827 C 0 0 0 0 0 1.2357 1.6075 0.1765 O 0 0 0 0 0 2.2923 -0.4942 -0.0030 C 0 0 0 0 0 3.5477 0.3370 0.0483 C 0 0 0 0 0 4.8834 -0.3222 -0.0204 C 0 0 0 0 0 4.9588 -1.5290 -0.1169 O 0 0 0 0 0 6.0043 0.4204 0.0260 O 0 0 0 0 0 3.4724 1.5388 0.1447 O 0 0 0 0 0 -0.4405 -1.5557 0.0718 C 0 0 0 0 0 -1.7124 -2.0868 0.0443 C 0 0 0 0 0 -2.8145 -1.2517 -0.0021 C 0 0 0 0 0 -2.6499 0.1232 -0.0148 C 0 0 0 0 0 -1.0727 2.5295 1.0058 H 0 0 0 0 0 -0.3320 2.4204 -0.6085 H 0 0 0 0 0 -2.0921 2.6309 -0.4493 H 0 0 0 0 0 2.2848 -1.1922 0.8342 H 0 0 0 0 0 2.2631 -1.0507 -0.9396 H 0 0 0 0 0 6.8467 -0.0517 -0.0225 H 0 0 0 0 0 0.4186 -2.2085 0.1075 H 0 0 0 0 0 -1.8487 -3.1582 0.0589 H 0 0 0 0 0 -3.8087 -1.6742 -0.0234 H 0 0 0 0 0 -3.5157 0.7686 -0.0468 H 0 0 0 0 0 1 2 1 0 0 0 1 16 1 0 0 0 1 17 1 0 0 0 1 18 1 0 0 0 2 15 2 0 0 0 2 3 1 0 0 0 4 3 1 0 0 0 3 12 2 0 0 0 5 4 2 0 0 0 4 6 1 0 0 0 7 6 1 0 0 0 6 19 1 0 0 0 6 20 1 0 0 0 11 7 2 0 0 0 7 8 1 0 0 0 9 8 2 0 0 0 8 10 1 0 0 0 10 21 1 0 0 0 12 13 1 0 0 0 12 22 1 0 0 0 14 13 2 0 0 0 13 23 1 0 0 0 15 14 1 0 0 0 14 24 1 0 0 0 15 25 1 0 0 0 M END $$$$