BUJI05 -OEChem-04042104233D 48 49 0 1 0 0 0 0 0999 V2000 3.7413 2.7832 1.0655 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.9304 2.8671 0.3518 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1363 -0.1801 0.7305 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9558 -0.0682 0.6433 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -1.0689 -0.8744 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3444 -2.2810 -0.2859 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7951 3.9612 -0.2409 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4173 -3.4194 -0.9102 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5612 -3.8450 1.1521 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9199 1.6500 -0.6674 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7577 0.5627 -0.7451 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2469 -1.2414 0.2378 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8805 -0.8274 -0.2963 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 0.2885 0.3891 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3509 1.1865 -0.3194 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6676 -0.1678 -0.4264 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0734 -1.9438 -0.8316 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9398 -0.6166 -0.0722 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5789 1.6428 0.4963 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3066 2.0918 0.1422 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4046 2.9639 -0.6191 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8426 3.0713 -1.0794 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1615 -2.4315 -0.9505 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1876 1.0950 0.3593 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8032 0.3560 1.4665 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6016 -1.6019 0.3203 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0175 -1.0176 1.4388 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9503 -0.7755 -0.7357 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8386 -3.0336 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1473 -1.8655 1.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -1.7204 -0.6518 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9983 -0.1280 -1.1341 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2468 -1.2886 -1.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5824 -2.8618 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2275 -1.6608 -0.1097 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1267 3.1520 0.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5628 0.9329 -0.9965 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0493 0.5100 -0.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9927 4.0717 -1.4983 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 2.3506 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8465 -2.7276 -0.9888 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6909 -3.0038 -1.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3965 -2.8388 0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -2.5682 -1.6667 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3462 0.8154 2.3369 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7225 -1.6161 2.2964 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4099 -1.1474 -1.6458 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5725 -4.3877 -0.9386 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 22 1 0 0 0 0 2 24 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 12 1 0 0 0 0 4 38 1 0 0 0 0 5 16 1 0 0 0 0 5 23 1 0 0 0 0 6 17 1 0 0 0 0 6 41 1 0 0 0 0 7 21 2 0 0 0 0 8 29 1 0 0 0 0 8 48 1 0 0 0 0 9 29 2 0 0 0 0 10 15 1 0 0 0 0 10 21 1 0 0 0 0 10 37 1 0 0 0 0 11 24 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 18 2 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 27 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END $$$$