BB1XP3 -OEChem-04012115262D 28 29 0 0 0 0 0 0 0999 V2000 5.3981 -1.5121 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.5121 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.3981 -1.5121 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -0.5362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 1.5121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.4879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.0121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.4879 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 0.9879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -0.5467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 1.5226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.9879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 2.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -1.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 2.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -0.3221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 0.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 0.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 -0.5777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4918 2.5097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 3.1321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2518 2.5145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 16 1 0 0 0 0 3 16 1 0 0 0 0 4 13 1 0 0 0 0 4 18 1 0 0 0 0 5 15 1 0 0 0 0 5 19 1 0 0 0 0 6 17 2 0 0 0 0 7 11 1 0 0 0 0 7 17 1 0 0 0 0 7 22 1 0 0 0 0 8 10 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 15 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 18 23 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 19 26 1 0 0 0 0 19 27 1 0 0 0 0 19 28 1 0 0 0 0 M END $$$$