NCI:100789 BBtclserve11129917252D 0 0.00000 0.00000 79000 13229-24-8 39 41 0 0 0 0 0 0 0 0 1 V2000 7.8903 0.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6574 0.6867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9512 0.3889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4855 1.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2527 2.3133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8673 -1.0962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0807 3.2984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3302 -2.9398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6345 -1.7376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0392 -0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7943 -2.9398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8479 3.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5736 -1.3940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4626 -2.7227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9783 0.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2721 0.5304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.4399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.4399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.5601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9399 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.5601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5601 0.0000 C 0 0 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 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 9 15 2 0 0 0 0 10 16 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 12 19 2 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 16 23 2 0 0 0 0 17 24 1 0 0 0 0 17 25 2 0 0 0 0 18 26 1 0 0 0 0 18 27 2 0 0 0 0 21 28 2 0 0 0 0 23 29 1 0 0 0 0 23 30 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 29 33 1 0 0 0 0 29 34 2 0 0 0 0 32 35 1 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 12 15 1 0 0 0 0 16 21 1 0 0 0 0 30 32 2 0 0 0 0 M END