BR9OE5 -OEChem-04022105122D 44 46 0 1 0 0 0 0 0999 V2000 9.7942 -1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.0600 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6603 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4482 1.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0497 0.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0029 0.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6044 1.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 0.4149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 0.4149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 13 2 0 0 0 0 3 16 2 0 0 0 0 4 9 1 0 0 0 0 4 13 1 0 0 0 0 4 29 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 5 30 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$