NCI:647249 BBtclserve11129920022D 0 0.00000 0.00000225286 999-99-9 33 35 0 0 0 0 0 0 0 0 2 V2000 4.5981 -1.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 -0.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 0.1856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 0.1856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -0.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -1.0745 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0949 -0.4054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6301 -2.0526 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 -1.0745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5661 -2.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5171 -2.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2603 -1.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0524 -0.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 -0.4054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -3.3398 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6761 -3.6488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9819 -4.0090 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 -4.3533 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8660 -5.3533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8533 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5103 0.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 1.9081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3293 2.7172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 3.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7305 3.7352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1482 4.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 5.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 1 5 2 0 0 0 0 2 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 1 9 1 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 12 13 2 0 0 0 0 9 14 2 0 0 0 0 5 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 15 20 2 0 0 0 0 17 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 11 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 3 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 4 5 1 0 0 0 0 13 14 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 6 6 1 8 -1 21 1 23 -1 24 1 26 -1 M END