5X Converted by convert_cif2sdf.py 2024/03/29 11:09:15 45 47 0 0 0 0 0 0 0 0999 V2000 5.7821 -0.7829 -0.0971 S 0 0 0 0 0 7.0717 -0.8402 0.4983 O 0 0 0 0 0 5.4847 -1.3572 -1.3627 O 0 0 0 0 0 4.7359 -1.4705 0.9856 N 0 0 0 0 0 5.3641 0.9245 -0.2152 C 0 0 0 0 0 5.9592 1.8422 0.6299 C 0 0 0 0 0 5.6311 3.1816 0.5366 C 0 0 0 0 0 4.7072 3.6043 -0.4005 C 0 0 0 0 0 4.1121 2.6866 -1.2466 C 0 0 0 0 0 4.4442 1.3479 -1.1574 C 0 0 0 0 0 0.7311 0.6542 -0.0116 C 0 0 0 0 0 -0.7598 0.5974 -0.2256 C 0 0 0 0 0 3.3566 -1.4419 0.7422 N 0 0 0 0 0 2.7909 -2.4409 0.0620 C 0 0 0 0 0 1.1662 -0.5238 0.8621 C 0 0 0 0 0 2.6386 -0.4270 1.1955 C 0 0 0 0 0 1.0572 -2.0920 -0.0638 S 0 0 0 0 0 3.5946 -3.8121 -0.5741 S 0 0 0 0 0 3.1167 0.4958 1.8209 O 0 0 0 0 0 -1.5696 1.2925 0.5619 C 0 0 0 0 0 -1.3314 -0.2487 -1.3341 C 0 0 0 0 0 -3.0331 1.1138 0.4597 C 0 0 0 0 0 -3.5734 -0.1621 0.2956 C 0 0 0 0 0 -3.8805 2.2199 0.5335 C 0 0 0 0 0 -5.2456 2.0468 0.4375 C 0 0 0 0 0 -4.9410 -0.3219 0.2013 C 0 0 0 0 0 -5.7749 0.7799 0.2696 C 0 0 0 0 0 5.0775 -1.8931 1.7887 H 0 0 0 0 0 6.6809 1.5123 1.3623 H 0 0 0 0 0 6.0960 3.8988 1.1977 H 0 0 0 0 0 4.4502 4.6504 -0.4730 H 0 0 0 0 0 3.3904 3.0165 -1.9790 H 0 0 0 0 0 3.9824 0.6315 -1.8204 H 0 0 0 0 0 1.2383 0.5990 -0.9750 H 0 0 0 0 0 0.9918 1.5896 0.4827 H 0 0 0 0 0 0.5667 -0.5696 1.7715 H 0 0 0 0 0 -1.1591 1.9882 1.2791 H 0 0 0 0 0 -1.5752 -1.2376 -0.9472 H 0 0 0 0 0 -2.2334 0.2235 -1.7227 H 0 0 0 0 0 -0.5968 -0.3422 -2.1338 H 0 0 0 0 0 -2.9231 -1.0219 0.2415 H 0 0 0 0 0 -3.4681 3.2096 0.6657 H 0 0 0 0 0 -5.9033 2.9023 0.4955 H 0 0 0 0 0 -5.3600 -1.3090 0.0733 H 0 0 0 0 0 -6.8447 0.6487 0.1944 H 0 0 0 0 0 1 2 2 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 1 5 1 0 0 0 4 13 1 0 0 0 4 28 1 0 0 0 5 6 1 0 0 0 5 10 2 0 0 0 6 7 2 0 0 0 6 29 1 0 0 0 7 8 1 0 0 0 7 30 1 0 0 0 8 9 2 0 0 0 8 31 1 0 0 0 9 10 1 0 0 0 9 32 1 0 0 0 10 33 1 0 0 0 11 12 1 0 0 0 11 15 1 0 0 0 11 34 1 0 0 0 11 35 1 0 0 0 12 20 2 0 0 0 12 21 1 0 0 0 13 14 1 0 0 0 13 16 1 0 0 0 14 17 1 0 0 0 14 18 2 0 0 0 15 16 1 0 0 0 15 17 1 0 0 0 15 36 1 0 0 0 16 19 2 0 0 0 20 22 1 0 0 0 20 37 1 0 0 0 21 38 1 0 0 0 21 39 1 0 0 0 21 40 1 0 0 0 22 23 1 0 0 0 22 24 2 0 0 0 23 26 2 0 0 0 23 41 1 0 0 0 24 25 1 0 0 0 24 42 1 0 0 0 25 27 2 0 0 0 25 43 1 0 0 0 26 27 1 0 0 0 26 44 1 0 0 0 27 45 1 0 0 0 M END $$$$