BRV1B5 -OEChem-04022100412D 46 46 0 1 0 0 0 0 0999 V2000 5.4641 4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.5950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 2.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 1.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 0.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -0.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 5.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 15 2 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 13 1 0 0 0 0 4 37 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 14 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 15 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 14 16 2 0 0 0 0 14 36 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 42 1 0 0 0 0 19 21 2 0 0 0 0 19 43 1 0 0 0 0 20 22 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 M END $$$$