CS9 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 84 87 0 0 0 0 0 0 0 0999 V2000 4.0941 1.6102 1.1987 C 0 0 0 0 0 2.9898 2.2422 1.7347 C 0 0 0 0 0 1.7273 1.7131 1.5518 C 0 0 0 0 0 1.5604 0.5338 0.8224 C 0 0 0 0 0 2.6705 -0.1085 0.2786 C 0 0 0 0 0 3.9414 0.4314 0.4665 C 0 0 0 0 0 5.1251 -0.2430 -0.1080 C 0 0 0 0 0 6.0431 0.4711 -0.7886 N 0 0 0 0 0 5.2702 -1.4424 0.0337 O 0 0 0 0 0 7.1386 -0.2139 -1.4790 C 0 0 0 0 0 6.7111 -0.5458 -2.9101 C 0 0 0 0 0 7.8554 -1.2616 -3.6321 C 0 0 0 0 0 5.9463 1.9319 -0.8378 C 0 0 0 0 0 6.9038 2.5408 0.1886 C 0 0 0 0 0 6.6966 4.0563 0.2418 C 0 0 0 0 0 3.1622 3.5139 2.5243 C 0 0 0 0 0 0.2082 -0.0323 0.6280 C 0 0 0 0 0 -0.8652 0.5898 1.1558 N 0 0 0 0 0 0.0638 -1.0581 -0.0076 O 0 0 0 0 0 -2.2042 0.0293 0.9626 C 0 0 0 0 0 -3.2457 1.1457 1.0746 C 0 0 0 0 0 -2.4735 -1.0274 2.0360 C 0 0 0 0 0 -3.2419 1.6690 2.4040 O 0 0 0 0 0 -1.5273 -2.1848 1.8487 C 0 0 0 0 0 -1.8830 -3.2448 1.0364 C 0 0 0 0 0 -1.0137 -4.3087 0.8645 C 0 0 0 0 0 0.2124 -4.3102 1.5064 C 0 0 0 0 0 0.5681 -3.2488 2.3203 C 0 0 0 0 0 -0.3010 -2.1841 2.4869 C 0 0 0 0 0 -1.3627 -5.3444 0.0705 F 0 0 0 0 0 1.7647 -3.2497 2.9479 F 0 0 0 0 0 -6.7959 1.1318 -0.1413 C 0 0 0 0 0 -5.9888 0.3707 -1.2143 C 0 0 0 0 0 -4.6669 0.0687 -0.6345 N 0 0 0 0 0 -5.6902 1.7146 0.7793 C 0 0 0 0 0 -4.6317 0.5842 0.7509 C 0 0 0 0 0 -7.5634 2.1800 -0.7346 O 0 0 0 0 0 -8.8171 1.8645 -1.1560 C 0 0 0 0 0 -9.2872 0.5661 -1.0262 C 0 0 0 0 0 -10.5608 0.2484 -1.4537 C 0 0 0 0 0 -11.3677 1.2228 -2.0118 C 0 0 0 0 0 -10.9008 2.5180 -2.1431 C 0 0 0 0 0 -9.6300 2.8421 -1.7109 C 0 0 0 0 0 5.0780 2.0322 1.3409 H 0 0 0 0 0 0.8680 2.2117 1.9743 H 0 0 0 0 0 2.5463 -1.0211 -0.2869 H 0 0 0 0 0 8.0149 0.4340 -1.5032 H 0 0 0 0 0 7.3823 -1.1352 -0.9497 H 0 0 0 0 0 5.8348 -1.1948 -2.8866 H 0 0 0 0 0 6.4674 0.3745 -3.4392 H 0 0 0 0 0 8.7306 -0.6135 -3.6554 H 0 0 0 0 0 8.0990 -2.1827 -3.1018 H 0 0 0 0 0 7.5507 -1.4983 -4.6506 H 0 0 0 0 0 6.2130 2.2799 -1.8345 H 0 0 0 0 0 4.9250 2.2357 -0.6072 H 0 0 0 0 0 6.7046 2.1123 1.1707 H 0 0 0 0 0 7.9321 2.3241 -0.0997 H 0 0 0 0 0 7.3790 4.4901 0.9733 H 0 0 0 0 0 6.8958 4.4848 -0.7403 H 0 0 0 0 0 5.6683 4.2732 0.5311 H 0 0 0 0 0 3.0992 4.3701 1.8527 H 0 0 0 0 0 2.3773 3.5844 3.2765 H 0 0 0 0 0 4.1355 3.5080 3.0144 H 0 0 0 0 0 -0.7497 1.4094 1.6623 H 0 0 0 0 0 -2.2684 -0.4299 -0.0240 H 0 0 0 0 0 -3.0020 1.9415 0.3700 H 0 0 0 0 0 -2.3233 -0.5900 3.0228 H 0 0 0 0 0 -3.5010 -1.3811 1.9478 H 0 0 0 0 0 -3.4511 1.0155 3.0843 H 0 0 0 0 0 -2.8400 -3.2425 0.5353 H 0 0 0 0 0 0.8912 -5.1398 1.3731 H 0 0 0 0 0 -0.0215 -1.3535 3.1186 H 0 0 0 0 0 -7.4406 0.4506 0.4152 H 0 0 0 0 0 -6.4996 -0.5556 -1.4754 H 0 0 0 0 0 -5.8702 0.9944 -2.1006 H 0 0 0 0 0 -4.4813 -0.9236 -0.6560 H 0 0 0 0 0 -5.2869 2.6386 0.3668 H 0 0 0 0 0 -6.0669 1.8717 1.7899 H 0 0 0 0 0 -4.8951 -0.2030 1.4562 H 0 0 0 0 0 -8.6575 -0.1960 -0.5903 H 0 0 0 0 0 -10.9272 -0.7630 -1.3528 H 0 0 0 0 0 -12.3628 0.9725 -2.3465 H 0 0 0 0 0 -11.5325 3.2769 -2.5803 H 0 0 0 0 0 -9.2676 3.8554 -1.8093 H 0 0 0 0 0 1 6 1 0 0 0 1 2 2 0 0 0 1 44 1 0 0 0 2 3 1 0 0 0 2 16 1 0 0 0 3 4 2 0 0 0 3 45 1 0 0 0 4 5 1 0 0 0 4 17 1 0 0 0 5 6 2 0 0 0 5 46 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 7 9 2 0 0 0 8 10 1 0 0 0 8 13 1 0 0 0 10 11 1 0 0 0 10 47 1 0 0 0 10 48 1 0 0 0 11 12 1 0 0 0 11 49 1 0 0 0 11 50 1 0 0 0 12 51 1 0 0 0 12 52 1 0 0 0 12 53 1 0 0 0 13 14 1 0 0 0 13 54 1 0 0 0 13 55 1 0 0 0 14 15 1 0 0 0 14 56 1 0 0 0 14 57 1 0 0 0 15 58 1 0 0 0 15 59 1 0 0 0 15 60 1 0 0 0 16 61 1 0 0 0 16 62 1 0 0 0 16 63 1 0 0 0 17 19 2 0 0 0 17 18 1 0 0 0 18 20 1 0 0 0 18 64 1 0 0 0 20 22 1 0 0 0 20 21 1 0 0 0 20 65 1 0 0 0 21 23 1 0 0 0 21 36 1 0 0 0 21 66 1 0 0 0 22 24 1 0 0 0 22 67 1 0 0 0 22 68 1 0 0 0 23 69 1 0 0 0 24 29 2 0 0 0 24 25 1 0 0 0 25 26 2 0 0 0 25 70 1 0 0 0 26 27 1 0 0 0 26 30 1 0 0 0 27 28 2 0 0 0 27 71 1 0 0 0 28 31 1 0 0 0 28 29 1 0 0 0 29 72 1 0 0 0 32 35 1 0 0 0 32 37 1 0 0 0 32 33 1 0 0 0 32 73 1 0 0 0 33 34 1 0 0 0 33 74 1 0 0 0 33 75 1 0 0 0 34 36 1 0 0 0 34 76 1 0 0 0 35 36 1 0 0 0 35 77 1 0 0 0 35 78 1 0 0 0 36 79 1 0 0 0 37 38 1 0 0 0 38 43 2 0 0 0 38 39 1 0 0 0 39 40 2 0 0 0 39 80 1 0 0 0 40 41 1 0 0 0 40 81 1 0 0 0 41 42 2 0 0 0 41 82 1 0 0 0 42 43 1 0 0 0 42 83 1 0 0 0 43 84 1 0 0 0 M END $$$$