NCI:637212 BBtclserve11129919562D 0 0.00000 0.00000220345 999-99-9 33 36 0 0 0 0 0 0 0 0 2 V2000 5.3147 0.0000 0.0000 Ti 0 0 0 0 0 0 0 0 0 0 0 0 4.9711 -0.9391 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 5.6584 -0.9391 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 6.1808 0.5000 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 6.1808 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.0000 0.0000 C 0 5 0 0 0 0 0 0 0 0 0 0 4.4487 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.5000 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 4.4487 -0.5000 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 4.4487 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.0000 0.0000 C 0 5 0 0 0 0 0 0 0 0 0 0 6.1808 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.5000 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 7.0468 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4781 2.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 3.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3364 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 1.5933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 4.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1513 -2.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1295 -3.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6295 -2.3364 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9603 -1.5933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8601 4.8966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8383 4.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1473 3.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4822 -3.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7912 -4.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7694 -4.8966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4385 -4.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 1 13 1 0 0 0 0 5 14 1 0 0 0 0 10 15 1 0 0 0 0 7 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 16 20 2 0 0 0 0 18 21 1 0 0 0 0 12 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 22 26 2 0 0 0 0 21 27 2 0 0 0 0 27 28 1 0 0 0 0 17 29 1 0 0 0 0 23 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 24 33 1 0 0 0 0 7 8 2 0 0 0 0 12 13 2 0 0 0 0 19 20 1 0 0 0 0 25 26 1 0 0 0 0 28 29 2 0 0 0 0 32 33 2 0 0 0 0 M CHG 8 2 -1 3 -1 4 1 6 -1 8 1 9 1 11 -1 13 1 M END