LJWP39 -OEChem-05032301132D 43 45 0 1 0 0 0 0 0999 V2000 10.7053 2.6623 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 2.0230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5771 2.1381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3008 -0.7165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6066 -0.3564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4432 0.6381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7111 0.6381 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7976 1.0449 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1284 0.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6284 -0.5643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5771 1.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3497 -1.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1418 -2.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 1.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -2.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1752 0.6381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 2.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0412 1.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0412 2.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1752 2.6381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9352 0.6035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9352 2.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 1.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 2.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2311 0.3005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1987 1.2053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7136 0.7625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6268 -0.0627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -0.8165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -1.1540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -1.7714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8133 -2.5295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4432 0.0181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4701 -3.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3457 -3.0877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2998 -2.2120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1752 0.0181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7722 2.4481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1752 3.2581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9280 -0.0165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9280 3.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 0.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 8 2 1 1 0 0 0 2 31 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 1 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 12 13 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 18 1 0 0 0 0 16 38 1 0 0 0 0 17 20 2 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 M END $$$$