2KE Converted by convert_cif2sdf.py 2024/03/29 11:09:15 73 76 0 0 0 0 0 0 0 0999 V2000 0.8243 -1.4254 0.6803 C 0 0 0 0 0 1.0995 -0.9141 -0.5750 C 0 0 0 0 0 -0.5216 0.4264 -1.8514 C 0 0 0 0 0 1.2213 -2.7123 1.0060 C 0 0 0 0 0 1.8967 -3.4871 0.0685 C 0 0 0 0 0 2.1701 -2.9688 -1.1870 C 0 0 0 0 0 1.7710 -1.6838 -1.5057 C 0 0 0 0 0 3.6492 2.3667 1.3221 C 0 0 0 0 0 -6.4505 -0.5668 0.0306 C 0 0 0 0 0 2.8690 -5.5305 -0.6638 C 0 0 0 0 0 -6.0348 0.7295 -0.2111 C 0 0 0 0 0 -1.7533 0.2081 -1.3509 N 0 0 0 0 0 6.8379 4.0801 0.8363 N 0 0 0 0 0 6.9571 4.0795 -0.4847 C 0 0 0 0 0 6.0146 3.5251 -1.2934 C 0 0 0 0 0 4.8775 2.9340 -0.7052 C 0 0 0 0 0 4.7686 2.9458 0.7088 C 0 0 0 0 0 5.8033 3.5474 1.4587 C 0 0 0 0 0 3.8664 2.3446 -1.4729 C 0 0 0 0 0 2.7817 1.7731 -0.8379 C 0 0 0 0 0 2.6794 1.7945 0.5581 C 0 0 0 0 0 5.7325 3.5769 2.8413 N 0 0 0 0 0 1.7694 1.1839 -1.5946 N 0 0 0 0 0 0.6674 0.4862 -0.9281 C 0 0 0 0 0 -0.3701 0.5749 -3.0459 O 0 0 0 0 0 2.2884 -4.7500 0.3837 O 0 0 0 0 0 0.9506 -3.2159 2.2403 O 0 0 0 0 0 0.2543 -2.3640 3.1512 C 0 0 0 0 0 0.0420 -3.0986 4.4762 C 0 0 0 0 0 4.3650 -5.2238 -0.7591 C 0 0 0 0 0 2.6712 -7.0175 -0.3617 C 0 0 0 0 0 -2.9098 0.1510 -2.2486 C 0 0 0 0 0 -4.1587 -0.1026 -1.4447 C 0 0 0 0 0 -4.8888 0.9611 -0.9488 C 0 0 0 0 0 -5.7165 -1.6305 -0.4593 C 0 0 0 0 0 -4.5677 -1.3988 -1.1929 C 0 0 0 0 0 -6.9669 2.0854 0.4182 S 0 0 0 0 0 -6.6585 3.2014 -0.4052 O 0 0 0 0 0 -8.2904 1.6065 0.6147 O 0 0 0 0 0 -6.3686 2.4349 1.9231 N 0 0 0 0 0 0.3029 -0.8198 1.4076 H 0 0 0 0 0 2.6946 -3.5685 -1.9162 H 0 0 0 0 0 1.9841 -1.2813 -2.4855 H 0 0 0 0 0 3.5593 2.3711 2.3985 H 0 0 0 0 0 -7.3459 -0.7480 0.6067 H 0 0 0 0 0 2.3859 -5.2852 -1.6090 H 0 0 0 0 0 -1.8751 0.0894 -0.3963 H 0 0 0 0 0 7.8292 4.5330 -0.9323 H 0 0 0 0 0 6.1347 3.5370 -2.3664 H 0 0 0 0 0 3.9370 2.3295 -2.5506 H 0 0 0 0 0 1.8197 1.3491 1.0359 H 0 0 0 0 0 4.9704 3.1842 3.2963 H 0 0 0 0 0 6.4433 3.9908 3.3542 H 0 0 0 0 0 1.7951 1.2363 -2.5632 H 0 0 0 0 0 0.3949 1.0222 -0.0185 H 0 0 0 0 0 0.8402 -1.4613 3.3251 H 0 0 0 0 0 -0.7126 -2.0920 2.7277 H 0 0 0 0 0 -0.5450 -4.0002 4.3023 H 0 0 0 0 0 1.0089 -3.3696 4.8997 H 0 0 0 0 0 -0.4898 -2.4483 5.1715 H 0 0 0 0 0 4.8070 -5.8187 -1.5582 H 0 0 0 0 0 4.5052 -4.1645 -0.9740 H 0 0 0 0 0 4.8470 -5.4691 0.1870 H 0 0 0 0 0 1.6058 -7.2355 -0.2927 H 0 0 0 0 0 3.1142 -7.6125 -1.1607 H 0 0 0 0 0 3.1542 -7.2629 0.5845 H 0 0 0 0 0 -3.0053 1.0976 -2.7799 H 0 0 0 0 0 -2.7709 -0.6566 -2.9678 H 0 0 0 0 0 -4.5640 1.9740 -1.1382 H 0 0 0 0 0 -6.0365 -2.6433 -0.2628 H 0 0 0 0 0 -3.9952 -2.2305 -1.5765 H 0 0 0 0 0 -5.6335 1.9158 2.2854 H 0 0 0 0 0 -6.7520 3.1596 2.4414 H 0 0 0 0 0 35 36 2 0 0 0 35 9 1 0 0 0 36 33 1 0 0 0 9 11 2 0 0 0 33 32 1 0 0 0 33 34 2 0 0 0 11 34 1 0 0 0 11 37 1 0 0 0 29 28 1 0 0 0 39 37 2 0 0 0 28 27 1 0 0 0 32 12 1 0 0 0 40 37 1 0 0 0 25 3 2 0 0 0 37 38 2 0 0 0 3 12 1 0 0 0 3 24 1 0 0 0 27 4 1 0 0 0 1 4 2 0 0 0 1 2 1 0 0 0 4 5 1 0 0 0 23 24 1 0 0 0 23 20 1 0 0 0 24 2 1 0 0 0 2 7 2 0 0 0 5 26 1 0 0 0 5 6 2 0 0 0 26 10 1 0 0 0 21 20 2 0 0 0 21 8 1 0 0 0 20 19 1 0 0 0 30 10 1 0 0 0 7 6 1 0 0 0 10 31 1 0 0 0 8 17 2 0 0 0 19 16 2 0 0 0 17 16 1 0 0 0 17 18 1 0 0 0 16 15 1 0 0 0 22 18 1 0 0 0 18 13 2 0 0 0 15 14 2 0 0 0 13 14 1 0 0 0 1 41 1 0 0 0 6 42 1 0 0 0 7 43 1 0 0 0 8 44 1 0 0 0 9 45 1 0 0 0 10 46 1 0 0 0 12 47 1 0 0 0 14 48 1 0 0 0 15 49 1 0 0 0 19 50 1 0 0 0 21 51 1 0 0 0 22 52 1 0 0 0 22 53 1 0 0 0 23 54 1 0 0 0 24 55 1 0 0 0 28 56 1 0 0 0 28 57 1 0 0 0 29 58 1 0 0 0 29 59 1 0 0 0 29 60 1 0 0 0 30 61 1 0 0 0 30 62 1 0 0 0 30 63 1 0 0 0 31 64 1 0 0 0 31 65 1 0 0 0 31 66 1 0 0 0 32 67 1 0 0 0 32 68 1 0 0 0 34 69 1 0 0 0 35 70 1 0 0 0 36 71 1 0 0 0 40 72 1 0 0 0 40 73 1 0 0 0 M END $$$$