BKD8B2 -OEChem-04022101252D 39 39 0 1 0 0 0 0 0999 V2000 4.5981 -1.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 3.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 4.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 4.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -5.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 13 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 16 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 15 2 0 0 0 0 11 29 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 M END $$$$