BXBF95 -OEChem-04012116572D 57 60 0 0 0 0 0 0 0999 V2000 6.3981 -0.7621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.7621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.2379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7654 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8718 2.2621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 -1.7621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.2621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 1.2621 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.5942 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 -1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4602 -0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4602 -2.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1923 -2.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 -1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9244 -2.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9244 -0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7904 -1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7904 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 0.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 1.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -0.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 -0.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9836 -1.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3822 -2.3447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8588 0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0617 0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0617 -2.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8588 -2.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9369 -0.8697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5383 -0.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1267 0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3297 0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7938 -2.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5908 -2.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4636 -1.2370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2607 -1.2370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5214 -0.4521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9244 -2.8821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9244 0.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3273 -2.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3273 -0.4521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 1.0479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 1.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -1.4167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1963 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 26 1 0 0 0 0 2 20 2 0 0 0 0 3 28 2 0 0 0 0 4 8 1 0 0 0 0 5 8 2 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 7 16 1 0 0 0 0 7 20 1 0 0 0 0 7 48 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 16 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 17 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 18 49 1 0 0 0 0 19 22 2 0 0 0 0 19 50 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 51 1 0 0 0 0 22 24 1 0 0 0 0 22 52 1 0 0 0 0 23 25 2 0 0 0 0 24 53 1 0 0 0 0 25 28 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 31 2 0 0 0 0 29 55 1 0 0 0 0 30 32 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 32 57 1 0 0 0 0 M CHG 2 4 -1 8 1 M END $$$$