IDS Converted by convert_cif2sdf.py 2024/03/01 05:07:52 27 27 0 0 0 0 0 0 0 0999 V2000 0.5504 -1.2622 0.1624 C 0 0 0 0 0 1.3891 -0.1936 -0.5386 C 0 0 0 0 0 0.5325 0.4971 -1.6028 C 0 0 0 0 0 -0.7521 1.0076 -0.9417 C 0 0 0 0 0 -1.4309 -0.1504 -0.2094 C 0 0 0 0 0 -2.7124 0.3342 0.4168 C 0 0 0 0 0 0.0838 -2.2083 -0.8011 O 0 0 0 0 0 1.8337 0.7715 0.4159 O 0 0 0 0 0 0.2021 -0.4330 -2.6359 O 0 0 0 0 0 -0.4323 2.0417 -0.0081 O 0 0 0 0 0 -0.5654 -0.6528 0.8072 O 0 0 0 0 0 -2.8661 0.2587 1.6127 O 0 0 0 0 0 -3.6821 0.8520 -0.3530 O 0 0 0 0 0 3.3522 0.6738 0.4657 S 0 0 0 0 0 3.7648 1.5910 1.4691 O 0 0 0 0 0 3.6499 -0.7150 0.4479 O 0 0 0 0 0 3.8872 1.2277 -0.8458 O 0 0 0 0 0 1.1618 -1.7740 0.9054 H 0 0 0 0 0 2.2523 -0.6616 -1.0132 H 0 0 0 0 0 1.0819 1.3360 -2.0287 H 0 0 0 0 0 -1.4243 1.4011 -1.7046 H 0 0 0 0 0 -1.6544 -0.9465 -0.9201 H 0 0 0 0 0 -0.4374 -2.8645 -0.3186 H 0 0 0 0 0 -0.3469 0.0418 -3.2753 H 0 0 0 0 0 -1.2667 2.3274 0.3881 H 0 0 0 0 0 -4.5034 1.1641 0.0490 H 0 0 0 0 0 4.8514 1.1623 -0.8044 H 0 0 0 0 0 1 2 1 0 0 0 1 7 1 0 0 0 1 11 1 0 0 0 1 18 1 0 0 0 2 3 1 0 0 0 2 8 1 0 0 0 2 19 1 0 0 0 3 4 1 0 0 0 3 9 1 0 0 0 3 20 1 0 0 0 4 5 1 0 0 0 4 10 1 0 0 0 4 21 1 0 0 0 5 6 1 0 0 0 5 11 1 0 0 0 5 22 1 0 0 0 6 12 2 0 0 0 6 13 1 0 0 0 7 23 1 0 0 0 8 14 1 0 0 0 9 24 1 0 0 0 10 25 1 0 0 0 13 26 1 0 0 0 14 15 2 0 0 0 14 16 2 0 0 0 14 17 1 0 0 0 17 27 1 0 0 0 M END $$$$