B5GE3I -OEChem-04022103172D 46 49 0 0 0 0 0 0 0999 V2000 2.0000 -0.5994 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.5172 -2.1629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7163 -0.9131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2364 3.5768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0343 -0.4995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6703 2.6758 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2693 0.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1703 0.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5842 0.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0561 -0.6762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0468 1.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0713 0.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2938 1.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2388 -2.8552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7559 -1.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5498 0.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5262 -1.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6703 2.6758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8238 0.1989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9995 -0.6323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4909 -1.5437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2843 2.2164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9604 -3.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5464 -3.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9311 -2.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8215 0.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0533 1.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6603 2.3788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4882 1.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2619 0.7939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8267 -2.1080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9393 3.2344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6789 -0.4039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1675 -2.0726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4153 2.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5311 -3.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4077 -3.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3896 -3.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 -3.1476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1172 -4.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9938 -4.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3785 -2.5629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3603 -1.6862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4837 -1.7044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2744 0.0748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6451 1.6988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 15 2 0 0 0 0 4 18 2 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 6 13 1 0 0 0 0 6 18 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 22 2 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 16 20 2 0 0 0 0 16 30 1 0 0 0 0 17 21 2 0 0 0 0 17 31 1 0 0 0 0 19 26 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 34 1 0 0 0 0 22 27 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$