BU5A2O -OEChem-04022104512D 51 50 0 0 0 0 0 0 0999 V2000 3.7320 -0.8100 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.8100 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.3100 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 10.6603 0.1900 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 8.9282 3.1900 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.1900 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3100 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2320 -3.6760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -1.9440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.6900 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9282 -0.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8162 3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5762 3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.7269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 27 1 0 0 0 0 3 9 1 0 0 0 0 3 10 2 0 0 0 0 3 11 2 0 0 0 0 3 28 1 0 0 0 0 7 31 2 0 0 0 0 8 32 1 0 0 0 0 12 37 1 0 0 0 0 12 51 1 0 0 0 0 13 37 2 0 0 0 0 14 38 1 0 0 0 0 15 38 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 22 1 0 0 0 0 18 21 1 0 0 0 0 18 23 2 0 0 0 0 19 24 1 0 0 0 0 19 27 2 0 0 0 0 20 25 2 0 0 0 0 20 40 1 0 0 0 0 21 26 2 0 0 0 0 21 39 1 0 0 0 0 22 29 2 0 0 0 0 22 41 1 0 0 0 0 23 30 1 0 0 0 0 23 42 1 0 0 0 0 24 28 2 0 0 0 0 25 31 1 0 0 0 0 25 36 1 0 0 0 0 26 32 1 0 0 0 0 26 35 1 0 0 0 0 27 33 1 0 0 0 0 28 34 1 0 0 0 0 29 31 1 0 0 0 0 29 37 1 0 0 0 0 30 32 2 0 0 0 0 30 38 1 0 0 0 0 33 34 2 0 0 0 0 33 43 1 0 0 0 0 34 44 1 0 0 0 0 35 45 1 0 0 0 0 35 46 1 0 0 0 0 35 47 1 0 0 0 0 36 48 1 0 0 0 0 36 49 1 0 0 0 0 36 50 1 0 0 0 0 M CHG 6 4 1 5 1 6 1 8 -1 9 -1 14 -1 M END $$$$