NCI:52311 BBtclserve11129917042D 0 0.00000 0.00000 44431 7147-62-8 45 48 0 0 0 0 0 0 0 0 2 V2000 7.1961 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1961 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1961 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6961 1.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0621 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6961 1.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0621 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1961 2.4820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1961 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 6.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -7.7500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 6.2500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7321 7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -8.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 -8.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 6.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 6 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 14 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 2 0 0 0 0 23 26 1 0 0 0 0 23 27 2 0 0 0 0 24 28 1 0 0 0 0 26 29 1 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 29 32 2 0 0 0 0 29 33 1 0 0 0 0 30 34 1 0 0 0 0 31 35 2 0 0 0 0 32 36 1 0 0 0 0 33 37 2 0 0 0 0 34 38 1 0 0 0 0 34 39 2 0 0 0 0 36 40 1 0 0 0 0 36 41 2 0 0 0 0 38 42 2 0 0 0 0 38 43 1 0 0 0 0 40 44 2 0 0 0 0 40 45 1 0 0 0 0 13 18 1 0 0 0 0 15 19 1 0 0 0 0 35 39 1 0 0 0 0 37 41 1 0 0 0 0 M CHG 4 38 1 40 1 43 -1 45 -1 M END