BRG0S3 -OEChem-04022101473D 41 43 0 0 0 0 0 0 0999 V2000 2.0181 -0.7134 -1.8245 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6714 3.9655 -0.4309 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.3580 -1.9927 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0236 -0.1526 -2.7122 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1371 -2.0535 0.6188 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9845 -0.0890 0.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1685 -0.5023 0.6327 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7284 0.4916 0.3043 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5676 -0.2740 0.8597 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -1.4399 0.3996 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5526 -1.7196 0.6929 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4961 -0.3439 -0.1787 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6261 1.8979 0.0981 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1271 0.6391 -0.1707 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9909 0.0237 2.1549 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7281 2.6043 -0.2222 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8481 -0.1162 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9519 -2.3775 0.3455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0298 1.9648 -0.3643 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3431 0.2514 2.4118 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2717 0.1814 1.3734 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -2.4845 -1.9209 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7102 -3.8411 -0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3515 4.4462 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1504 -2.6962 0.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3699 2.3018 0.2196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0741 0.1299 -0.2825 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 0.0826 2.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5941 -0.1732 -0.7095 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8919 2.5653 -0.6293 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6729 0.4827 3.4204 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3246 0.3567 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8417 -2.7843 -2.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -2.7903 -1.7172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4375 -2.9307 -1.1999 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0844 -3.8808 -0.9485 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6664 -4.3234 -0.2748 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2236 -4.3670 0.7723 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3884 5.5270 -0.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3438 4.0497 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0101 4.3367 0.7688 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 12 1 0 0 0 0 1 22 1 0 0 0 0 2 16 1 0 0 0 0 2 24 1 0 0 0 0 5 18 2 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 14 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 13 1 0 0 0 0 9 12 1 0 0 0 0 9 15 2 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 25 1 0 0 0 0 12 17 2 0 0 0 0 13 16 2 0 0 0 0 13 26 1 0 0 0 0 14 19 2 0 0 0 0 14 27 1 0 0 0 0 15 20 1 0 0 0 0 15 28 1 0 0 0 0 16 19 1 0 0 0 0 17 21 1 0 0 0 0 17 29 1 0 0 0 0 18 23 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 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 M END $$$$