CIJ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 31 33 0 0 0 0 0 0 0 0999 V2000 5.3256 2.3543 1.5513 CL 0 0 0 0 0 0.5636 2.2364 -0.8912 O 0 0 0 0 0 0.1461 -2.2442 -0.6924 O 0 0 0 0 0 -4.6799 -0.7915 1.5015 O 0 0 0 0 0 -2.6577 -2.4305 0.5839 O 0 0 0 0 0 5.8892 -0.3745 2.5190 F 0 0 0 0 0 -3.4114 1.1276 0.9189 C 0 0 0 0 0 4.3641 -1.4988 1.0966 C 0 0 0 0 0 3.4072 -1.4522 0.1012 C 0 0 0 0 0 -2.2620 1.6973 0.3950 C 0 0 0 0 0 3.6289 0.9300 -0.0056 C 0 0 0 0 0 1.9969 -0.1897 -1.5370 C 0 0 0 0 0 -3.5478 -0.2487 0.9841 C 0 0 0 0 0 4.9548 -0.3293 1.5447 C 0 0 0 0 0 -2.5235 -1.0829 0.5195 C 0 0 0 0 0 4.5862 0.8865 0.9920 C 0 0 0 0 0 3.0397 -0.2383 -0.4505 C 0 0 0 0 0 0.0842 1.1416 -0.6705 C 0 0 0 0 0 -0.1214 -1.0654 -0.5731 C 0 0 0 0 0 -1.2381 0.8873 -0.0689 C 0 0 0 0 0 -1.3690 -0.5195 -0.0072 C 0 0 0 0 0 0.6701 -0.0396 -0.9348 N 0 0 0 0 0 -5.3741 -0.9508 0.8472 H 0 0 0 0 0 -3.0624 -2.8239 -0.2019 H 0 0 0 0 0 -4.2049 1.7632 1.2840 H 0 0 0 0 0 4.6472 -2.4472 1.5293 H 0 0 0 0 0 2.9456 -2.3642 -0.2478 H 0 0 0 0 0 -2.1645 2.7717 0.3478 H 0 0 0 0 0 3.3416 1.8778 -0.4367 H 0 0 0 0 0 2.1965 0.6570 -2.1937 H 0 0 0 0 0 2.0314 -1.1135 -2.1147 H 0 0 0 0 0 1 16 1 0 0 0 2 18 2 0 0 0 3 19 2 0 0 0 4 13 1 0 0 0 5 15 1 0 0 0 6 14 1 0 0 0 7 10 2 0 0 0 7 13 1 0 0 0 8 9 2 0 0 0 8 14 1 0 0 0 9 17 1 0 0 0 10 20 1 0 0 0 11 16 1 0 0 0 11 17 2 0 0 0 12 17 1 0 0 0 12 22 1 0 0 0 13 15 2 0 0 0 14 16 2 0 0 0 15 21 1 0 0 0 18 20 1 0 0 0 18 22 1 0 0 0 19 21 1 0 0 0 19 22 1 0 0 0 20 21 2 0 0 0 4 23 1 0 0 0 5 24 1 0 0 0 7 25 1 0 0 0 8 26 1 0 0 0 9 27 1 0 0 0 10 28 1 0 0 0 11 29 1 0 0 0 12 30 1 0 0 0 12 31 1 0 0 0 M END $$$$