0QW Converted by convert_cif2sdf.py 2024/03/29 11:09:15 27 28 0 0 0 0 0 0 0 0999 V2000 2.7948 0.8997 0.9268 C 0 0 0 0 0 3.7145 0.6457 -0.2853 C 0 0 0 0 0 2.8483 -0.2675 -1.1940 C 0 0 0 0 0 1.4307 0.3043 -0.9458 C 0 0 0 0 0 1.4131 0.6658 0.4836 N 0 0 0 0 0 0.3121 0.7632 1.2556 C 0 0 0 0 0 0.4680 1.0667 2.9327 S 0 0 0 0 0 -1.0244 0.6096 0.6552 C 0 0 0 0 0 -1.6669 -0.6316 0.6787 C 0 0 0 0 0 -2.9176 -0.7683 0.1166 C 0 0 0 0 0 -3.5421 0.3193 -0.4726 C 0 0 0 0 0 -2.9186 1.5512 -0.5027 C 0 0 0 0 0 -1.6626 1.7085 0.0637 C 0 0 0 0 0 -1.0508 2.9196 0.0395 O 0 0 0 0 0 3.0461 0.2117 1.7340 H 0 0 0 0 0 2.9058 1.9295 1.2661 H 0 0 0 0 0 3.9526 1.5807 -0.7927 H 0 0 0 0 0 4.6247 0.1305 0.0221 H 0 0 0 0 0 3.1347 -0.1628 -2.2403 H 0 0 0 0 0 2.9125 -1.3080 -0.8752 H 0 0 0 0 0 1.2648 1.1871 -1.5630 H 0 0 0 0 0 0.6740 -0.4523 -1.1569 H 0 0 0 0 0 -1.1836 -1.4822 1.1357 H 0 0 0 0 0 -3.4124 -1.7275 0.1336 H 0 0 0 0 0 -4.5216 0.2030 -0.9106 H 0 0 0 0 0 -3.4119 2.3938 -0.9643 H 0 0 0 0 0 -0.5029 3.0683 -0.7425 H 0 0 0 0 0 7 6 2 0 0 0 1 5 1 0 0 0 1 2 1 0 0 0 9 10 2 0 0 0 9 8 1 0 0 0 6 5 1 0 0 0 6 8 1 0 0 0 5 4 1 0 0 0 10 11 1 0 0 0 8 13 2 0 0 0 2 3 1 0 0 0 4 3 1 0 0 0 11 12 2 0 0 0 13 12 1 0 0 0 13 14 1 0 0 0 1 15 1 0 0 0 1 16 1 0 0 0 2 17 1 0 0 0 2 18 1 0 0 0 3 19 1 0 0 0 3 20 1 0 0 0 4 21 1 0 0 0 4 22 1 0 0 0 9 23 1 0 0 0 10 24 1 0 0 0 11 25 1 0 0 0 12 26 1 0 0 0 14 27 1 0 0 0 M END $$$$