NCI:243427 BBtclserve11129918322D 0 0.00000 0.00000151113 52995-63-8 32 35 0 0 0 0 0 0 0 0 2 V2000 2.0000 -0.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9749 -0.4751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1975 -1.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 0.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0984 -1.8839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3712 -2.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1645 1.2077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5984 0.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9994 -1.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1732 -2.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -3.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2219 -0.4751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0323 1.2077 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7812 -2.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3469 -3.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0162 1.3863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5584 2.0883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6322 -3.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7121 -1.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4217 -4.4416 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 0.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1505 2.3772 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2495 2.8111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -3.6858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4939 -2.3316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 2.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0709 3.7950 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3449 -3.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8817 2.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8338 4.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1295 4.1324 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.7623 2.7993 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 17 23 2 0 0 0 0 18 24 1 0 0 0 0 19 25 2 0 0 0 0 22 26 1 0 0 0 0 23 27 1 0 0 0 0 24 28 2 0 0 0 0 26 29 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 29 32 1 0 0 0 0 9 12 2 0 0 0 0 11 15 1 0 0 0 0 22 23 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 3 13 1 27 1 31 -1 M END