BPUR78 -OEChem-04012115052D 41 40 0 1 0 0 0 0 0999 V2000 3.5010 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 6.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 5.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 3.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 4.6200 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7331 5.1200 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5991 4.6200 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2690 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 3.6200 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8671 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 3.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 5.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 5.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 4.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 4.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 4.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0044 4.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8015 4.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8796 6.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 6.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 6.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0021 4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 5.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 4.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 7.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 6.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 6.0831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 41 1 0 0 0 0 7 2 1 6 0 0 0 2 32 1 0 0 0 0 8 3 1 1 0 0 0 3 33 1 0 0 0 0 11 4 1 1 0 0 0 4 40 1 0 0 0 0 6 5 1 1 0 0 0 5 10 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 11 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 15 1 0 0 0 0 11 25 1 0 0 0 0 12 15 2 0 0 0 0 12 26 1 0 0 0 0 13 16 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 17 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 M END $$$$