B8LKB9 -OEChem-04022106223D 42 43 0 1 0 0 0 0 0999 V2000 5.9908 3.8090 -0.3609 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.8233 -0.5068 -0.0496 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4408 -0.4985 1.4063 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0747 -0.9582 -1.9285 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6614 -1.4878 -0.3087 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1920 1.2928 -0.0082 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1301 0.8424 -2.0794 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9393 -1.5330 0.3662 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7770 -2.7346 -0.1038 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6852 -0.2260 0.1885 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0445 -4.0599 0.0665 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4908 0.2627 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5668 0.4881 -1.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5162 -0.9707 0.2752 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1779 1.4655 1.0533 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2538 1.6909 -1.1676 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6721 -1.0507 -0.6592 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0593 2.1796 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1016 0.0789 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9689 -0.5197 -0.7936 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1487 0.7389 -0.6657 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1268 -0.0190 1.3438 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1835 0.5383 2.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1822 1.1777 1.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7253 -1.6589 1.4362 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0473 -2.6191 -1.1614 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7183 -2.7723 0.4584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6198 -1.8000 -1.2752 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1549 -4.1155 -0.5683 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7024 -4.8893 -0.2124 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -4.2071 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5928 -0.2853 2.1499 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9605 0.1254 -1.8291 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8019 1.8321 1.8643 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1537 2.2335 -2.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -2.1043 -0.9079 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -0.4894 -1.5704 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3451 -0.5334 1.8962 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2258 0.4716 3.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0287 1.6280 1.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 1.3257 -2.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2348 0.8921 -2.5495 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 17 1 0 0 0 0 2 20 1 0 0 0 0 3 14 2 0 0 0 0 4 20 2 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 5 28 1 0 0 0 0 6 21 1 0 0 0 0 6 24 2 0 0 0 0 7 21 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 15 1 0 0 0 0 12 32 1 0 0 0 0 13 16 2 0 0 0 0 13 33 1 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$