90R Converted by convert_cif2sdf.py 2024/03/29 11:09:15 22 23 0 0 0 0 0 0 0 0999 V2000 -0.3239 -2.7058 0.1927 O 0 0 0 0 0 0.0180 -1.5404 0.1385 C 0 0 0 0 0 -0.9988 -0.4722 0.1116 C 0 0 0 0 0 -2.3608 -0.7769 0.1487 C 0 0 0 0 0 -2.7690 -2.0683 0.2085 O 0 0 0 0 0 -3.2990 0.2556 0.1220 C 0 0 0 0 0 -2.8870 1.5696 0.0613 C 0 0 0 0 0 -1.5358 1.8850 0.0240 C 0 0 0 0 0 -0.5858 0.8718 0.0498 C 0 0 0 0 0 0.8586 1.1850 0.0122 C 0 0 0 0 0 1.2307 2.3403 -0.0421 O 0 0 0 0 0 1.8450 0.0890 0.0405 C 0 0 0 0 0 3.3158 0.4117 0.0022 C 0 0 0 0 0 1.4503 -1.1898 0.1047 C 0 0 0 0 0 -2.9035 -2.4787 -0.6560 H 0 0 0 0 0 -4.3536 0.0237 0.1499 H 0 0 0 0 0 -3.6227 2.3599 0.0416 H 0 0 0 0 0 -1.2236 2.9180 -0.0239 H 0 0 0 0 0 3.6884 0.5316 1.0192 H 0 0 0 0 0 3.8533 -0.3994 -0.4879 H 0 0 0 0 0 3.4702 1.3370 -0.5528 H 0 0 0 0 0 2.1910 -1.9746 0.1291 H 0 0 0 0 0 5 4 1 0 0 0 1 2 2 0 0 0 4 6 2 0 0 0 4 3 1 0 0 0 6 7 1 0 0 0 2 3 1 0 0 0 2 14 1 0 0 0 3 9 2 0 0 0 7 8 2 0 0 0 14 12 2 0 0 0 9 8 1 0 0 0 9 10 1 0 0 0 10 12 1 0 0 0 10 11 2 0 0 0 12 13 1 0 0 0 5 15 1 0 0 0 6 16 1 0 0 0 7 17 1 0 0 0 8 18 1 0 0 0 13 19 1 0 0 0 13 20 1 0 0 0 13 21 1 0 0 0 14 22 1 0 0 0 M END $$$$