BA3Y6S -OEChem-04022107182D 43 46 0 1 0 0 0 0 0999 V2000 4.6254 3.1816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9344 2.2306 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2434 3.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4344 3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9563 2.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8005 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0684 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 3.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2872 1.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8005 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0684 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 3.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.9033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.8544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0684 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8005 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0684 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8005 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 -3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 2.2306 0.0000 B 0 5 3 0 0 0 0 0 0 0 0 0 6.5241 2.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9344 1.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8098 2.9295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5534 3.7186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8493 4.2302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0196 4.2302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3374 1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5315 1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0621 3.8503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4788 1.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3374 -0.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5315 -0.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4775 4.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8941 1.4425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3936 2.9833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5315 -1.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3374 -1.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5315 -3.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3374 -3.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 -4.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 5 23 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 6 23 1 0 0 0 0 7 11 1 0 0 0 0 7 30 1 0 0 0 0 8 12 2 0 0 0 0 8 31 1 0 0 0 0 9 14 1 0 0 0 0 9 32 1 0 0 0 0 10 15 2 0 0 0 0 10 33 1 0 0 0 0 11 13 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 17 1 0 0 0 0 14 16 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 M CHG 2 2 1 23 -1 M END $$$$