BBO74D -OEChem-04012112142D 44 46 0 0 0 0 0 0 0999 V2000 13.7583 -0.0560 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.3100 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.7583 1.6760 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1233 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 27 1 0 0 0 0 3 27 1 0 0 0 0 4 11 1 0 0 0 0 4 19 1 0 0 0 0 5 19 2 0 0 0 0 6 10 1 0 0 0 0 6 19 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 29 1 0 0 0 0 8 12 2 0 0 0 0 8 24 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 20 2 0 0 0 0 10 21 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 14 16 2 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 22 1 0 0 0 0 17 24 2 0 0 0 0 17 27 1 0 0 0 0 18 22 2 0 0 0 0 18 34 1 0 0 0 0 20 25 1 0 0 0 0 20 35 1 0 0 0 0 21 26 2 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 28 2 0 0 0 0 25 42 1 0 0 0 0 26 28 1 0 0 0 0 26 43 1 0 0 0 0 28 44 1 0 0 0 0 M END $$$$