NCI:291050 BBtclserve11129918452D 0 0.00000 0.00000164209 42545-56-2 28 30 0 0 0 0 0 0 0 0 2 V2000 4.0823 0.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -0.1307 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -0.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4483 0.7353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4483 -0.9967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8143 -0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 1.9571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8143 -1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 -0.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3502 -1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 2.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 -2.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5464 -0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3502 -2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 3.7172 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5464 -1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -3.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.6126 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2163 -4.1307 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3502 -4.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -4.6307 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 7 1 0 0 0 0 3 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 2 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 9 15 1 0 0 0 0 10 16 1 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 15 21 1 0 0 0 0 17 22 2 0 0 0 0 19 23 2 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 15 16 2 0 0 0 0 18 22 1 0 0 0 0 20 23 1 0 0 0 0 M CHG 4 21 1 25 -1 26 1 28 -1 M END