BM2S1I -OEChem-04022107342D 53 55 0 1 0 0 0 0 0999 V2000 4.7026 0.4632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 3.4117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7254 5.0298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0314 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.3187 4.1162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 -0.9381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 0.6711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 1.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4997 2.3936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9064 3.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -3.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -3.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.9487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -2.6390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.4487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.1390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -1.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -1.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6405 -1.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.7214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.7214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 -0.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.1514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7041 1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -3.7214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.7214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -5.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -5.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8831 2.3288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.1514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 4.0514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 5.5314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 16 1 0 0 0 0 2 10 1 0 0 0 0 2 20 1 0 0 0 0 3 29 2 0 0 0 0 4 6 1 0 0 0 0 4 53 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 29 1 0 0 0 0 6 52 1 0 0 0 0 7 10 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 11 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 12 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 17 1 0 0 0 0 13 38 1 0 0 0 0 14 18 1 0 0 0 0 14 39 1 0 0 0 0 15 19 2 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 41 1 0 0 0 0 18 21 2 0 0 0 0 18 42 1 0 0 0 0 19 21 1 0 0 0 0 19 43 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 44 1 0 0 0 0 22 27 2 0 0 0 0 22 45 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 28 2 0 0 0 0 25 48 1 0 0 0 0 26 28 1 0 0 0 0 26 49 1 0 0 0 0 27 29 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END $$$$