BR40OY -OEChem-04042104203D 51 53 0 0 0 0 0 0 0999 V2000 6.0407 1.4470 -0.4797 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8188 -2.0888 -0.7461 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -3.5497 -0.8583 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8723 2.4647 0.5459 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2866 0.7024 -0.5681 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5727 2.1656 1.9684 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7961 2.7999 0.0155 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -0.0583 0.3901 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7233 -2.4621 1.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2842 1.9276 0.7719 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5182 0.9056 1.4019 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4651 2.1104 1.3878 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4434 1.7305 0.3252 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1487 0.4815 -0.2253 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4194 -1.2844 0.0961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1906 -1.6154 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -2.9745 0.5074 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5315 2.4717 -0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9428 -0.0528 -1.2295 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3619 -3.3725 1.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3347 1.9419 -1.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0417 0.6886 -1.6751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7032 -1.6149 -0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6215 -2.6280 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7357 0.2865 -0.3382 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5189 0.6233 0.2549 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5027 -0.3274 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -1.9516 -0.7411 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9363 -1.0010 -0.8363 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7566 2.2339 -2.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4928 1.2017 1.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5053 0.4197 2.3837 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9306 3.0291 1.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9592 2.2346 2.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4391 -0.8378 0.7379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4522 -1.6249 1.9733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3965 -3.7472 0.6913 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4377 -2.9856 -0.5721 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7572 3.4414 0.3205 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7465 -1.0173 -1.6811 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5383 -3.3884 2.3256 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0604 -4.3807 0.9402 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6771 0.2889 -2.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1930 2.5028 -1.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8456 -1.7120 1.6723 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -0.0293 0.7872 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0963 -2.9499 -1.1328 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8709 -1.2875 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 1.4791 -2.8353 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 2.7299 -2.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5469 2.9715 -2.2034 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 25 1 0 0 0 0 1 30 1 0 0 0 0 2 15 2 0 0 0 0 3 24 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 20 1 0 0 0 0 9 24 1 0 0 0 0 9 45 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 20 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 21 1 0 0 0 0 18 39 1 0 0 0 0 19 22 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$