CIN Converted by convert_cif2sdf.py 2024/03/29 11:09:15 22 22 0 0 0 0 0 0 0 0999 V2000 -0.3021 -0.4929 0.0434 C 0 0 0 0 0 0.5723 -1.5841 0.0432 C 0 0 0 0 0 1.9326 -1.3749 0.0432 C 0 0 0 0 0 2.4396 -0.0723 0.0435 C 0 0 0 0 0 1.5661 1.0170 0.0448 C 0 0 0 0 0 0.2058 0.8097 0.0387 C 0 0 0 0 0 -1.7574 -0.7154 0.0434 C 0 0 0 0 0 -2.6007 0.3359 0.0437 C 0 0 0 0 0 -4.0481 0.1144 0.0437 C 0 0 0 0 0 3.8999 0.1503 0.0435 C 0 0 0 0 0 -4.4895 -1.0180 0.0434 O 0 0 0 0 0 -4.8914 1.1668 0.0439 O 0 0 0 0 0 4.6598 -0.7963 0.0432 O 0 0 0 0 0 4.3889 1.4058 0.0438 O 0 0 0 0 0 0.1804 -2.5904 0.0429 H 0 0 0 0 0 2.6083 -2.2168 0.0430 H 0 0 0 0 0 1.9590 2.0232 0.0450 H 0 0 0 0 0 -0.4689 1.6526 0.0390 H 0 0 0 0 0 -2.1503 -1.7217 0.0432 H 0 0 0 0 0 -2.2089 1.3422 0.0439 H 0 0 0 0 0 -5.8479 1.0208 0.0439 H 0 0 0 0 0 5.3455 1.5518 0.0438 H 0 0 0 0 0 1 2 2 0 0 0 1 6 1 0 0 0 1 7 1 0 0 0 2 3 1 0 0 0 2 15 1 0 0 0 3 4 2 0 0 0 3 16 1 0 0 0 4 5 1 0 0 0 4 10 1 0 0 0 5 6 2 0 0 0 5 17 1 0 0 0 6 18 1 0 0 0 7 8 2 0 0 0 7 19 1 0 0 0 8 9 1 0 0 0 8 20 1 0 0 0 9 11 2 0 0 0 9 12 1 0 0 0 10 13 2 0 0 0 10 14 1 0 0 0 12 21 1 0 0 0 14 22 1 0 0 0 M END $$$$