JOD Converted by convert_cif2sdf.py 2024/03/01 05:07:52 26 28 0 0 0 0 0 0 0 0999 V2000 -2.7751 -0.6311 0.2142 C 0 0 0 0 0 -0.4027 -2.3877 0.1898 O 0 0 0 0 0 -0.2512 -0.9671 0.1476 C 0 0 0 0 0 1.0352 -0.5115 0.8580 C 0 0 0 0 0 0.9892 1.0008 1.1004 C 0 0 0 0 0 0.0674 1.6477 0.0425 C 0 0 0 0 0 0.4434 0.9637 -1.2983 C 0 0 0 0 0 -0.1945 -0.4455 -1.3002 C 0 0 0 0 0 -1.2880 1.1503 0.3363 N 0 0 0 0 0 -1.4248 -0.2491 0.8479 C 0 0 0 0 0 -3.4432 0.6723 0.1119 O 0 0 0 0 0 -2.5033 1.6411 0.1845 C 0 0 0 0 0 -2.7502 2.8286 0.1173 O 0 0 0 0 0 -2.6316 -1.0737 -0.7719 H 0 0 0 0 0 -3.3336 -1.3061 0.8640 H 0 0 0 0 0 0.3194 -2.8727 -0.2314 H 0 0 0 0 0 1.1241 -1.0294 1.8141 H 0 0 0 0 0 1.8975 -0.7514 0.2355 H 0 0 0 0 0 0.5972 1.1988 2.0983 H 0 0 0 0 0 1.9946 1.4149 1.0149 H 0 0 0 0 0 0.1325 2.7354 0.0225 H 0 0 0 0 0 0.0510 1.5490 -2.1299 H 0 0 0 0 0 1.5266 0.8800 -1.3825 H 0 0 0 0 0 0.4123 -1.1175 -1.9073 H 0 0 0 0 0 -1.2007 -0.3887 -1.7164 H 0 0 0 0 0 -1.4143 -0.3292 1.9352 H 0 0 0 0 0 13 12 2 0 0 0 11 12 1 0 0 0 11 1 1 0 0 0 7 8 1 0 0 0 7 6 1 0 0 0 12 9 1 0 0 0 8 3 1 0 0 0 1 10 1 0 0 0 6 9 1 0 0 0 6 5 1 0 0 0 9 10 1 0 0 0 10 3 1 0 0 0 3 2 1 0 0 0 3 4 1 0 0 0 5 4 1 0 0 0 1 14 1 0 0 0 1 15 1 0 0 0 2 16 1 0 0 0 4 17 1 0 0 0 4 18 1 0 0 0 5 19 1 0 0 0 5 20 1 0 0 0 6 21 1 0 0 0 7 22 1 0 0 0 7 23 1 0 0 0 8 24 1 0 0 0 8 25 1 0 0 0 10 26 1 0 0 0 M END $$$$