LB2Y8A -OEChem-05022323103D 50 52 0 1 0 0 0 0 0999 V2000 3.1247 -2.9011 1.9737 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5094 0.2608 -0.2711 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9847 2.4551 0.8316 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3971 1.3564 0.4988 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6987 2.3241 -1.0979 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9794 1.9407 -1.2022 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5102 -3.5296 0.9035 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0503 0.1749 1.0742 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1698 0.7601 1.9449 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 2.0698 1.2487 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1789 2.5667 0.7419 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5718 -0.8082 0.0422 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1392 1.3027 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6566 -2.1756 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9725 -0.3092 -1.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5583 2.6303 -0.4984 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1421 -3.0440 -0.6736 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -1.1777 -2.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5428 -2.5452 -1.9131 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9015 2.2572 -0.3798 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3332 1.8090 -0.7155 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6429 0.4031 -0.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8704 -0.5828 -1.2494 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7037 0.0830 1.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1589 -1.8887 -0.8533 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9921 -1.2229 1.4632 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2198 -2.2087 0.5031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2872 -0.3031 1.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0356 0.1022 2.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7747 0.9864 2.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0083 2.7873 1.9171 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2034 1.8806 0.4099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2677 3.1645 -0.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6582 3.1547 1.5054 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 0.7480 -1.4396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1897 3.1085 -1.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4238 3.2795 0.3707 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2156 -4.1126 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7716 -0.7894 -3.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7228 2.1254 -2.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9212 -3.2211 -2.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8047 1.7740 -2.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0078 2.1123 -1.5242 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4882 2.5118 0.1114 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8257 -0.3450 -2.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 0.8407 1.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3341 -2.6482 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0361 -1.4600 2.5232 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6773 -4.2442 0.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5566 -3.7619 1.8867 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 13 2 0 0 0 0 3 20 2 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 16 1 0 0 0 0 5 20 1 0 0 0 0 5 40 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 6 42 1 0 0 0 0 7 27 1 0 0 0 0 7 49 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 15 18 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 41 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 45 1 0 0 0 0 24 26 2 0 0 0 0 24 46 1 0 0 0 0 25 27 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$