NCI:87404 BBtclserve11129917182D 0 0.00000 0.00000 69018 1169-60-4 26 29 0 0 0 0 0 0 0 0 2 V2000 5.9163 2.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5776 3.2204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9005 2.1025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 1.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2231 3.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 0.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4049 2.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4049 0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5388 1.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4049 -0.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5388 0.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0760 0.3594 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1369 -0.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 1.8248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -1.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5389 -1.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 0.2067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8432 -0.2820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2479 1.3445 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 1.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5389 -2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 -2.9842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4049 -2.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 -3.9842 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 2 0 0 0 0 4 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 7 10 2 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 10 15 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 17 23 2 0 0 0 0 22 24 1 0 0 0 0 22 25 2 0 0 0 0 24 26 1 0 0 0 0 10 12 1 0 0 0 0 14 16 1 0 0 0 0 18 21 1 0 0 0 0 23 25 1 0 0 0 0 M CHG 2 13 1 20 -1 M END