NCI:55294 BBtclserve11129917072D 0 0.00000 0.00000 46493 6622-86-2 20 21 0 0 0 0 0 0 0 0 2 V2000 4.5981 1.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5687 2.7820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3777 1.3808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 2.9899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.1239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9535 3.9035 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9481 4.0080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3658 4.7125 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 2 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 9 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 9 10 2 0 0 0 0 19 20 1 0 0 0 0 M CHG 2 12 1 15 -1 M END