93D Converted by convert_cif2sdf.py 2024/03/29 11:09:15 35 36 0 0 0 0 0 0 0 0999 V2000 -5.2589 1.0612 -0.4317 P 0 0 0 0 0 -5.7407 1.7553 -1.8016 O 0 0 0 0 0 -3.9189 0.2105 -0.7037 O 0 0 0 0 0 -3.3012 -0.6087 0.2910 C 0 0 0 0 0 -2.0546 -1.2732 -0.2964 C 0 0 0 0 0 -1.4408 -2.2600 0.7213 C 0 0 0 0 0 -1.8489 -3.5985 0.4299 O 0 0 0 0 0 0.0837 -2.1037 0.5234 C 0 0 0 0 0 0.2105 -1.0414 -0.5902 C 0 0 0 0 0 -1.0221 -0.2906 -0.5263 O 0 0 0 0 0 1.3879 -0.1397 -0.3236 C 0 0 0 0 0 1.2325 1.0340 0.3879 C 0 0 0 0 0 2.2878 1.8045 0.6065 N 0 0 0 0 0 3.4850 1.4636 0.1522 C 0 0 0 0 0 3.6762 0.3479 -0.5346 N 0 0 0 0 0 2.6626 -0.4748 -0.7855 C 0 0 0 0 0 2.8655 -1.6415 -1.5031 N 0 0 0 0 0 4.5613 2.2988 0.3960 N 0 0 0 0 0 -4.9583 2.1971 0.6696 O 0 0 0 0 0 -6.5438 2.2857 -1.7122 H 0 0 0 0 0 -3.0165 0.0079 1.1435 H 0 0 0 0 0 -4.0031 -1.3763 0.6165 H 0 0 0 0 0 -2.3029 -1.7895 -1.2241 H 0 0 0 0 0 -1.7263 -1.9876 1.7370 H 0 0 0 0 0 -1.4925 -4.2602 1.0384 H 0 0 0 0 0 0.5529 -1.7524 1.4424 H 0 0 0 0 0 0.5261 -3.0484 0.2055 H 0 0 0 0 0 0.3119 -1.5211 -1.5637 H 0 0 0 0 0 0.2610 1.3208 0.7626 H 0 0 0 0 0 3.7523 -1.8640 -1.8277 H 0 0 0 0 0 2.1204 -2.2372 -1.6829 H 0 0 0 0 0 5.4428 2.0634 0.0646 H 0 0 0 0 0 4.4346 3.1193 0.8975 H 0 0 0 0 0 -4.2701 2.8243 0.4094 H 0 0 0 0 0 -6.3228 0.1606 0.0652 O 0 0 0 0 0 18 14 1 0 0 0 14 15 2 0 0 0 14 13 1 0 0 0 15 16 1 0 0 0 13 12 2 0 0 0 16 17 1 0 0 0 16 11 2 0 0 0 12 11 1 0 0 0 11 9 1 0 0 0 9 10 1 0 0 0 9 8 1 0 0 0 10 5 1 0 0 0 8 6 1 0 0 0 19 1 1 0 0 0 5 4 1 0 0 0 5 6 1 0 0 0 1 3 1 0 0 0 1 2 1 0 0 0 3 4 1 0 0 0 6 7 1 0 0 0 2 20 1 0 0 0 4 21 1 0 0 0 4 22 1 0 0 0 5 23 1 0 0 0 6 24 1 0 0 0 7 25 1 0 0 0 8 26 1 0 0 0 8 27 1 0 0 0 9 28 1 0 0 0 12 29 1 0 0 0 17 30 1 0 0 0 17 31 1 0 0 0 18 32 1 0 0 0 18 33 1 0 0 0 19 34 1 0 0 0 1 35 2 0 0 0 M END $$$$