B8TXS7 -OEChem-04022100542D 28 29 0 0 0 0 0 0 0999 V2000 3.4030 -0.8343 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 0.5317 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -1.2003 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.3343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.0317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -1.7003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 -0.3690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.6657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 1.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 0.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 1.1865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5312 -0.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.9543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.2857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7538 2.3203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2028 1.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2191 -0.8942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0669 -0.6705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8432 0.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 0.0317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 9 1 0 0 0 0 2 9 1 0 0 0 0 3 9 1 0 0 0 0 4 27 1 0 0 0 0 5 28 1 0 0 0 0 7 10 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 15 17 2 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 23 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 M END $$$$