B3K6MR -OEChem-04022102342D 54 55 0 0 0 0 0 0 0999 V2000 3.7320 -1.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -6.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -7.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 7.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 7.5000 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 6.3301 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 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 6.3301 -0.0000 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 4.5981 -2.0000 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 3.7320 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 6.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 5.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 3.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 4.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 5.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 6.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2382 6.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 7.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6182 8.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5062 8.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 7.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 6.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -0.3100 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 5.1350 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 2 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 5 15 2 0 0 0 0 6 26 2 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 8 46 1 0 0 0 0 9 21 1 0 0 0 0 9 24 1 0 0 0 0 9 51 1 0 0 0 0 10 24 1 0 0 0 0 10 26 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 19 47 1 0 0 0 0 20 23 2 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 27 30 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 31 1 0 0 0 0 30 31 2 0 0 0 0 M END $$$$