BWN9H2 -OEChem-04022102482D 55 59 0 1 0 0 0 0 0999 V2000 8.7240 2.3450 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1765 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6062 3.2734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7946 -2.5606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0675 -2.5373 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.0675 -0.8053 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0675 -2.5373 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8914 2.1122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 2.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1988 1.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9136 2.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4839 -0.0006 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5377 -0.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 0.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5377 -1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4839 -1.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0675 -0.8053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6717 0.1947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1911 1.5805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2068 0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6717 -1.8053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5675 -1.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8056 -0.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8056 -1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0012 2.1669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0168 0.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9140 1.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5675 -1.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0675 -2.5373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5675 -3.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5675 -3.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1331 1.8717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3322 2.8005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4305 3.6152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5265 3.3233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5846 1.0754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 0.5410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2995 2.2366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8909 1.7022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.4034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6501 -0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9599 -0.1947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6717 0.8147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6252 1.8337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2705 -0.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6717 -2.4253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2687 0.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2687 -1.6153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9374 2.7836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5828 0.5107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8775 -1.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4475 -2.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2575 -3.9403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8775 -3.9403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 11 1 0 0 0 0 2 13 1 0 0 0 0 3 12 1 0 0 0 0 3 41 1 0 0 0 0 4 17 2 0 0 0 0 5 7 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 29 1 0 0 0 0 7 32 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 2 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 22 2 0 0 0 0 18 23 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 24 1 0 0 0 0 19 44 1 0 0 0 0 20 26 1 0 0 0 0 20 45 1 0 0 0 0 21 27 2 0 0 0 0 21 46 1 0 0 0 0 22 25 1 0 0 0 0 22 47 1 0 0 0 0 23 29 2 0 0 0 0 23 30 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 28 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 M CHG 2 5 -1 7 1 M END $$$$