BNA2B7 -OEChem-04012119012D 28 29 0 0 0 0 0 0 0999 V2000 3.4030 -1.9208 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -1.7255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5309 -0.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -1.0547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -2.7868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5256 2.1975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 2.7355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -0.1160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 0.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -0.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2364 1.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5471 1.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2374 1.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6441 0.9218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.6992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 0.4211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8502 0.9534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7182 2.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 14 1 0 0 0 0 2 12 1 0 0 0 0 2 15 1 0 0 0 0 3 15 2 0 0 0 0 4 27 1 0 0 0 0 7 19 1 0 0 0 0 7 28 1 0 0 0 0 8 19 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 17 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 16 1 0 0 0 0 13 18 2 0 0 0 0 13 22 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 16 23 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 M END $$$$