JH3 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 45 45 0 0 0 0 0 0 0 0999 V2000 -5.7402 0.8779 -0.2618 C 0 0 0 0 0 -6.4827 0.1359 -0.8738 O 0 0 0 0 0 -6.2485 1.9050 0.4481 O 0 0 0 0 0 -7.6912 2.0631 0.4373 C 0 0 0 0 0 -4.2879 0.6526 -0.2916 C 0 0 0 0 0 -3.7959 -0.4388 -0.8728 C 0 0 0 0 0 -4.7268 -1.5249 -1.3462 C 0 0 0 0 0 -2.3081 -0.5885 -1.0565 C 0 0 0 0 0 -1.7284 -1.3918 0.1096 C 0 0 0 0 0 -0.2396 -1.5416 -0.0741 C 0 0 0 0 0 0.5825 -1.0744 0.8319 C 0 0 0 0 0 0.0499 -0.2717 1.9905 C 0 0 0 0 0 2.0610 -1.3413 0.7165 C 0 0 0 0 0 2.7396 -0.1607 0.0195 C 0 0 0 0 0 4.2410 -0.4316 -0.0973 C 0 0 0 0 0 4.7955 -0.5505 -1.4089 O 0 0 0 0 0 5.1158 0.6588 -0.7183 C 0 0 0 0 0 6.5407 0.8200 -0.1848 C 0 0 0 0 0 4.4295 1.9462 -1.1804 C 0 0 0 0 0 -7.9667 2.9246 1.0462 H 0 0 0 0 0 -8.0322 2.2194 -0.5866 H 0 0 0 0 0 -8.1588 1.1667 0.8430 H 0 0 0 0 0 -3.6205 1.3730 0.1581 H 0 0 0 0 0 -5.1004 -1.2753 -2.3400 H 0 0 0 0 0 -4.1890 -2.4720 -1.3878 H 0 0 0 0 0 -5.5642 -1.6134 -0.6550 H 0 0 0 0 0 -2.1080 -1.1110 -1.9919 H 0 0 0 0 0 -1.8441 0.3975 -1.0854 H 0 0 0 0 0 -1.9275 -0.8693 1.0451 H 0 0 0 0 0 -2.1914 -2.3778 0.1375 H 0 0 0 0 0 0.1488 -2.0337 -0.9535 H 0 0 0 0 0 -0.2722 -0.9470 2.7832 H 0 0 0 0 0 0.8338 0.3851 2.3683 H 0 0 0 0 0 -0.7979 0.3282 1.6580 H 0 0 0 0 0 2.4859 -1.4690 1.7126 H 0 0 0 0 0 2.2227 -2.2491 0.1346 H 0 0 0 0 0 2.3147 -0.0340 -0.9757 H 0 0 0 0 0 2.5780 0.7460 0.6024 H 0 0 0 0 0 4.6745 -1.0417 0.6950 H 0 0 0 0 0 7.0921 -0.1078 -0.3354 H 0 0 0 0 0 7.0390 1.6299 -0.7185 H 0 0 0 0 0 6.5057 1.0542 0.8785 H 0 0 0 0 0 3.9410 2.4229 -0.3309 H 0 0 0 0 0 5.1737 2.6245 -1.5990 H 0 0 0 0 0 3.6862 1.7088 -1.9416 H 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 5 1 0 0 0 3 4 1 0 0 0 4 20 1 0 0 0 4 21 1 0 0 0 4 22 1 0 0 0 5 6 2 0 0 0 5 23 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 7 24 1 0 0 0 7 25 1 0 0 0 7 26 1 0 0 0 8 9 1 0 0 0 8 27 1 0 0 0 8 28 1 0 0 0 9 10 1 0 0 0 9 29 1 0 0 0 9 30 1 0 0 0 10 11 2 0 0 0 10 31 1 0 0 0 11 12 1 0 0 0 11 13 1 0 0 0 12 32 1 0 0 0 12 33 1 0 0 0 12 34 1 0 0 0 13 14 1 0 0 0 13 35 1 0 0 0 13 36 1 0 0 0 14 15 1 0 0 0 14 37 1 0 0 0 14 38 1 0 0 0 15 16 1 0 0 0 15 17 1 0 0 0 15 39 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 17 19 1 0 0 0 18 40 1 0 0 0 18 41 1 0 0 0 18 42 1 0 0 0 19 43 1 0 0 0 19 44 1 0 0 0 19 45 1 0 0 0 M END $$$$