BWB1F2 -OEChem-04022105222D 50 53 0 1 0 0 0 0 0999 V2000 5.4641 3.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7500 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4641 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 2.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7500 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.0901 -0.2847 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 1.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 2.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 3.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 4.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 4.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 4.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 4.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 5.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 5.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 2.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 1.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 -0.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 6 20 1 0 0 0 0 6 47 1 0 0 0 0 7 22 2 0 0 0 0 8 11 1 0 0 0 0 8 15 1 0 0 0 0 9 18 1 0 0 0 0 9 24 2 0 0 0 0 10 22 1 0 0 0 0 10 25 1 0 0 0 0 10 44 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 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 17 19 2 0 0 0 0 17 40 1 0 0 0 0 18 20 2 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 27 30 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 31 1 0 0 0 0 30 31 2 0 0 0 0 31 50 1 0 0 0 0 M END $$$$