LJ2A6D -OEChem-05022321283D 29 30 0 0 0 0 0 0 0999 V2000 -0.3519 -2.4659 0.6505 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.8228 1.8439 -0.1864 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2045 -0.4448 0.5365 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0832 2.0136 0.1729 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6135 3.6752 -0.2784 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9215 -2.0153 -1.2144 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6589 -1.5416 0.9979 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3186 0.2220 0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7269 -0.0795 -0.0242 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9913 0.0953 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2477 -0.6084 0.3201 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8231 1.4371 0.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5258 -0.0089 1.1171 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2897 -0.4415 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8874 -0.3000 1.0344 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6514 -0.7327 -1.3306 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9279 -0.9403 -0.5975 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8058 2.4695 -0.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4503 -0.6619 -0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 -1.5160 -0.1507 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 0.2704 2.0793 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6812 -0.5028 -2.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5094 -0.2452 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0897 -1.0149 -2.2835 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3477 -1.7351 -1.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1189 -0.1291 -1.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5104 -0.8887 -0.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7415 2.7379 0.1052 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7851 -2.3985 -0.9505 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 17 1 0 0 0 0 4 18 1 0 0 0 0 4 28 1 0 0 0 0 5 18 2 0 0 0 0 6 20 1 0 0 0 0 6 29 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 14 16 2 0 0 0 0 14 22 1 0 0 0 0 15 19 2 0 0 0 0 15 23 1 0 0 0 0 16 19 1 0 0 0 0 16 24 1 0 0 0 0 17 20 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 19 27 1 0 0 0 0 M END $$$$