BK1QR9 -OEChem-04022104532D 22 20 0 1 0 0 0 0 0999 V2000 5.4641 1.8450 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 3.9641 2.7110 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6550 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 4.5981 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6550 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3301 2.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 2.7110 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9641 0.9790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 1 9 2 0 0 0 0 4 11 1 0 0 0 0 5 16 1 0 0 0 0 6 21 1 0 0 0 0 7 17 1 0 0 0 0 7 22 1 0 0 0 0 10 17 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 14 16 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 M CHG 4 2 1 3 1 5 -1 8 -1 M END $$$$