B3BUP0 -OEChem-04022105212D 29 28 0 0 0 0 0 0 0999 V2000 7.8671 1.3100 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 3.2150 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 3.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 4.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 0.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 4.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 6.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 6.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 3.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5369 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 5.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6720 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2269 3.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8469 2.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 6.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 6.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 6.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 6.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 29 1 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 4 15 2 0 0 0 0 5 11 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 15 1 0 0 0 0 6 17 2 0 0 0 0 7 17 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 17 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 9 15 1 0 0 0 0 10 12 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 M END $$$$