BR8NT5 -OEChem-04022107082D 53 56 0 1 0 0 0 0 0999 V2000 6.3301 -0.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.5173 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 -3.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 1.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 2.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 3.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -3.4097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -4.0999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -4.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -4.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 -2.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 -1.9347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 -4.5543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -4.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5062 -3.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 0.4001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 1.0903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 1.0653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 0.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 1.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 3.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 2.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 3.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 2 11 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 8 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 11 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 19 1 0 0 0 0 14 42 1 0 0 0 0 15 20 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 1 0 0 0 0 17 23 2 0 0 0 0 18 24 1 0 0 0 0 18 26 2 0 0 0 0 19 22 2 0 0 0 0 19 45 1 0 0 0 0 20 22 1 0 0 0 0 20 46 1 0 0 0 0 21 25 1 0 0 0 0 21 44 1 0 0 0 0 22 48 1 0 0 0 0 23 27 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 28 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 M END $$$$