B5G8BP -OEChem-04012112592D 29 30 0 0 0 0 0 0 0999 V2000 4.4487 -0.5386 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9487 -3.0774 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.5547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4487 -0.5386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4487 -0.5386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9519 -2.4865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4167 -0.8392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.4614 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2978 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.5386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.9614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 1.9560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2577 -2.1264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 2.1639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6397 -2.1264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 2.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9487 -3.0774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 3.0774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2088 -1.8173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9856 0.7714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -1.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 2.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 3.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8064 3.0858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5843 -3.5790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 3.3296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8411 3.6438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 2.8252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5416 -2.2949 0.0000 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 8 1 0 0 0 0 1 10 1 0 0 0 0 2 13 1 0 0 0 0 2 17 1 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 6 19 1 0 0 0 0 6 29 1 0 0 0 0 7 19 2 0 0 0 0 8 11 1 0 0 0 0 8 20 1 0 0 0 0 9 14 2 0 0 0 0 10 13 2 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 13 19 1 0 0 0 0 14 18 1 0 0 0 0 15 17 2 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 M END $$$$