NCI:64896 BBtclserve11129917102D 0 0.00000 0.00000 52857 6958-81-2 28 30 0 0 0 0 0 0 0 0 1 V2000 8.6131 -0.2127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1131 0.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1131 -1.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1131 0.6533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6131 1.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6131 -1.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1131 -1.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6131 1.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1131 2.3853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6131 -1.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1131 -2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6131 -1.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1131 2.3853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6131 3.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1131 -2.8108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1131 -1.0788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1131 -2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6131 -1.9448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6131 3.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1131 -2.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2304 -2.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2304 -1.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3066 -3.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3066 -0.6382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3827 -2.8687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3827 -1.0209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.9448 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 2 0 0 0 0 8 13 1 0 0 0 0 9 14 2 0 0 0 0 10 15 1 0 0 0 0 10 16 2 0 0 0 0 11 17 2 0 0 0 0 12 18 1 0 0 0 0 13 19 2 0 0 0 0 15 20 1 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 12 17 1 0 0 0 0 14 19 1 0 0 0 0 26 27 1 0 0 0 0 M END