0NJ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 28 30 0 0 0 0 0 0 0 0999 V2000 -3.3719 -2.0445 -0.0083 F 0 0 0 0 0 -3.9189 -0.8096 -0.0041 C 0 0 0 0 0 -5.2937 -0.6601 -0.0016 C 0 0 0 0 0 -5.8540 0.6046 0.0036 C 0 0 0 0 0 -5.0446 1.7268 0.0073 C 0 0 0 0 0 -3.6720 1.5933 0.0049 C 0 0 0 0 0 -3.0976 0.3207 0.0057 C 0 0 0 0 0 -1.6268 0.1703 0.0032 C 0 0 0 0 0 -0.7754 -1.3671 0.0031 S 0 0 0 0 0 0.7722 -0.5256 0.0010 C 0 0 0 0 0 -0.7868 1.1489 -0.0041 N 0 0 0 0 0 0.5256 0.8527 -0.0006 C 0 0 0 0 0 1.6297 1.7322 -0.0069 C 0 0 0 0 0 2.9023 1.2486 -0.0025 C 0 0 0 0 0 3.1408 -0.1228 0.0101 C 0 0 0 0 0 2.0797 -1.0069 -0.0006 C 0 0 0 0 0 4.4171 -0.5914 0.0135 O 0 0 0 0 0 5.4652 0.3805 0.0053 C 0 0 0 0 0 -5.9309 -1.5314 -0.0052 H 0 0 0 0 0 -6.9283 0.7155 0.0052 H 0 0 0 0 0 -5.4898 2.7109 0.0065 H 0 0 0 0 0 -3.0429 2.4705 0.0074 H 0 0 0 0 0 1.4637 2.7994 -0.0166 H 0 0 0 0 0 3.7346 1.9360 -0.0089 H 0 0 0 0 0 2.2627 -2.0709 0.0001 H 0 0 0 0 0 5.3817 0.9959 -0.8905 H 0 0 0 0 0 5.3817 1.0123 0.8895 H 0 0 0 0 0 6.4300 -0.1267 0.0095 H 0 0 0 0 0 5 6 2 0 0 0 5 4 1 0 0 0 6 7 1 0 0 0 4 3 2 0 0 0 13 12 2 0 0 0 13 14 1 0 0 0 11 12 1 0 0 0 11 8 2 0 0 0 7 8 1 0 0 0 7 2 2 0 0 0 3 2 1 0 0 0 12 10 1 0 0 0 14 15 2 0 0 0 8 9 1 0 0 0 2 1 1 0 0 0 10 9 1 0 0 0 10 16 2 0 0 0 15 16 1 0 0 0 15 17 1 0 0 0 17 18 1 0 0 0 3 19 1 0 0 0 4 20 1 0 0 0 5 21 1 0 0 0 6 22 1 0 0 0 13 23 1 0 0 0 14 24 1 0 0 0 16 25 1 0 0 0 18 26 1 0 0 0 18 27 1 0 0 0 18 28 1 0 0 0 M END $$$$