NCI:664874 BBtclserve11129920092D 0 0.00000 0.00000232698 999-99-9 46 50 0 0 0 0 0 0 0 0 2 V2000 6.8301 1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5211 0.3300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2578 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 0.3300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4179 2.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4124 1.9855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0002 2.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5935 3.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 3.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0112 3.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2423 2.0901 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6491 3.0036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0613 3.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 4.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8803 5.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8857 5.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 4.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0668 3.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5701 0.0210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -1.7578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.2578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2578 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -7.2578 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 6.4488 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6992 7.2578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2815 6.5533 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 6 11 2 0 0 0 0 2 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 14 19 2 0 0 0 0 3 20 2 0 0 0 0 4 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 32 37 2 0 0 0 0 28 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 28 42 2 0 0 0 0 40 43 1 0 0 0 0 16 44 1 0 0 0 0 44 45 2 0 0 0 0 44 46 1 0 0 0 0 4 5 1 0 0 0 0 10 11 1 0 0 0 0 18 19 1 0 0 0 0 36 37 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 2 44 1 46 -1 M END