9NG Converted by convert_cif2sdf.py 2024/03/29 11:09:15 57 62 0 0 0 0 0 0 0 0999 V2000 1.4125 -0.1428 -0.1465 C 0 0 0 0 0 0.9422 -1.4988 0.3190 C 0 0 0 0 0 -0.3017 -1.6986 -0.2677 C 0 0 0 0 0 5.5776 1.9401 1.0539 C 0 0 0 0 0 1.6035 0.7921 1.0441 C 0 0 0 0 0 -1.8987 -0.4931 -1.8073 C 0 0 0 0 0 -0.9840 -2.8859 -0.0127 C 0 0 0 0 0 -4.8977 1.3161 0.6470 C 0 0 0 0 0 2.0169 2.1795 0.5420 C 0 0 0 0 0 6.4949 1.0554 0.6623 C 0 0 0 0 0 7.1624 0.4132 1.6916 C 0 0 0 0 0 1.5648 -4.9455 2.5223 BR 0 0 0 0 0 0.8098 -3.6309 1.3920 C 0 0 0 0 0 -0.4284 -3.8419 0.8116 C 0 0 0 0 0 -0.6484 -0.5970 -1.0520 N 0 0 0 0 0 -2.9564 0.1444 -0.9428 C 0 0 0 0 0 -3.1090 1.5197 -0.9439 C 0 0 0 0 0 -4.0750 2.1090 -0.1538 C 0 0 0 0 0 -4.7375 -0.0697 0.6430 C 0 0 0 0 0 -3.7681 -0.6475 -0.1503 C 0 0 0 0 0 -5.9317 1.9435 1.5002 C 0 0 0 0 0 -6.7956 1.3001 2.3238 N 0 0 0 0 0 -7.5699 2.3155 2.9123 N 0 0 0 0 0 -7.1454 3.4337 2.4325 N 0 0 0 0 0 -6.1815 3.2313 1.6083 N 0 0 0 0 0 0.2997 0.3574 -1.0351 C 0 0 0 0 0 0.2662 1.4180 -1.6221 O 0 0 0 0 0 3.1960 2.0354 -0.3230 N 0 0 0 0 0 3.1310 1.1049 -1.4589 C 0 0 0 0 0 2.7089 -0.2741 -0.9411 C 0 0 0 0 0 4.5728 2.9062 -0.0244 S 0 0 0 0 0 4.1715 4.0494 0.7180 O 0 0 0 0 0 5.2720 2.9871 -1.2588 O 0 0 0 0 0 6.7860 0.7757 2.9182 C 0 0 0 0 0 5.5168 1.9894 2.8115 S 0 0 0 0 0 1.4958 -2.4540 1.1422 C 0 0 0 0 0 0.6672 0.8711 1.5978 H 0 0 0 0 0 2.3801 0.3957 1.6976 H 0 0 0 0 0 -1.7381 0.1184 -2.6953 H 0 0 0 0 0 -2.2271 -1.4882 -2.1071 H 0 0 0 0 0 -1.9521 -3.0586 -0.4611 H 0 0 0 0 0 1.1985 2.6216 -0.0266 H 0 0 0 0 0 2.2630 2.8172 1.3912 H 0 0 0 0 0 6.7020 0.8544 -0.3783 H 0 0 0 0 0 7.9298 -0.3266 1.5137 H 0 0 0 0 0 -0.9626 -4.7606 1.0061 H 0 0 0 0 0 -2.4718 2.1324 -1.5629 H 0 0 0 0 0 -4.1945 3.1832 -0.1562 H 0 0 0 0 0 -5.3709 -0.6887 1.2612 H 0 0 0 0 0 -3.6435 -1.7199 -0.1535 H 0 0 0 0 0 -6.8646 0.3439 2.4739 H 0 0 0 0 0 2.3994 1.4636 -2.1827 H 0 0 0 0 0 4.1115 1.0345 -1.9300 H 0 0 0 0 0 3.4914 -0.6755 -0.2968 H 0 0 0 0 0 2.5517 -0.9461 -1.7839 H 0 0 0 0 0 7.1949 0.3827 3.8375 H 0 0 0 0 0 2.4627 -2.2849 1.5923 H 0 0 0 0 0 1 2 1 0 0 0 1 26 1 0 0 0 1 30 1 0 0 0 2 3 2 0 0 0 2 36 1 0 0 0 3 7 1 0 0 0 3 15 1 0 0 0 4 10 2 0 0 0 4 31 1 0 0 0 4 35 1 0 0 0 5 9 1 0 0 0 6 15 1 0 0 0 6 16 1 0 0 0 7 14 2 0 0 0 8 18 2 0 0 0 8 19 1 0 0 0 8 21 1 0 0 0 9 28 1 0 0 0 10 11 1 0 0 0 11 34 2 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 13 36 2 0 0 0 15 26 1 0 0 0 16 17 2 0 0 0 16 20 1 0 0 0 17 18 1 0 0 0 19 20 2 0 0 0 21 22 1 0 0 0 21 25 2 0 0 0 22 23 1 0 0 0 23 24 2 0 0 0 24 25 1 0 0 0 26 27 2 0 0 0 28 29 1 0 0 0 28 31 1 0 0 0 29 30 1 0 0 0 31 32 2 0 0 0 31 33 2 0 0 0 34 35 1 0 0 0 5 37 1 0 0 0 5 38 1 0 0 0 6 39 1 0 0 0 6 40 1 0 0 0 7 41 1 0 0 0 9 42 1 0 0 0 9 43 1 0 0 0 10 44 1 0 0 0 11 45 1 0 0 0 14 46 1 0 0 0 17 47 1 0 0 0 18 48 1 0 0 0 19 49 1 0 0 0 20 50 1 0 0 0 22 51 1 0 0 0 29 52 1 0 0 0 29 53 1 0 0 0 30 54 1 0 0 0 30 55 1 0 0 0 34 56 1 0 0 0 36 57 1 0 0 0 5 1 1 0 0 0 M END $$$$