NCI:651744 BBtclserve11129920052D 0 0.00000 0.00000227258 999-99-9 33 34 0 0 0 0 0 0 0 0 2 V2000 7.0468 0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.2885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 2.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3141 5.2296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7208 6.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1331 6.9521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1385 6.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7318 5.9341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3196 5.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.7885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.2885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.7885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.2885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.2885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -3.7885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -3.2885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -4.7885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -5.2885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4781 -6.2830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -6.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.6249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -4.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 -3.9036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 -6.9521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9074 4.1070 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0 7.0468 3.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 4.2115 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1207 3.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1697 4.8806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 7 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 8 13 1 0 0 0 0 2 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 22 26 1 0 0 0 0 26 27 2 0 0 0 0 23 28 2 0 0 0 0 5 30 1 0 0 0 0 13 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 6 7 1 0 0 0 0 12 13 2 0 0 0 0 25 26 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 2 29 -1 31 1 M END