BUA5P8 -OEChem-04022103012D 43 45 0 0 0 0 0 0 0999 V2000 2.0000 1.5600 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4400 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -1.3060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 0.4260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 -1.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9248 -1.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 0.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 0.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8554 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 6 1 0 0 0 0 2 12 1 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 31 1 0 0 0 0 6 14 1 0 0 0 0 6 32 1 0 0 0 0 7 13 1 0 0 0 0 7 14 2 0 0 0 0 8 13 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 15 33 1 0 0 0 0 16 21 2 0 0 0 0 16 34 1 0 0 0 0 17 23 1 0 0 0 0 17 35 1 0 0 0 0 18 24 2 0 0 0 0 18 36 1 0 0 0 0 19 25 2 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 42 1 0 0 0 0 23 26 2 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 41 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$