BUP3Q8 -OEChem-04022104512D 21 22 0 0 0 0 0 0 0999 V2000 2.9176 1.6896 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.1550 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3981 1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.6550 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8000 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.6897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.9996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.4879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 10 1 0 0 0 0 2 21 1 0 0 0 0 3 13 2 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 11 13 1 0 0 0 0 12 15 2 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$