NCI:290418 BBtclserve11129918452D 0 0.00000 0.00000163875 72855-69-7 25 28 0 0 0 0 0 0 0 0 2 V2000 4.4373 0.2788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3884 0.5878 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6942 0.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1974 0.0000 0.0000 Ni 0 0 0 0 0 0 0 0 0 0 0 0 5.6974 1.5388 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 3.9021 1.9260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 0.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0064 -0.5878 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3884 -0.5878 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 7.0064 0.5878 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 6.6974 1.5388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 2.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9575 -0.2788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6974 -1.5388 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.6974 -1.5388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2852 2.3479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 2.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7006 -0.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1096 -2.3479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4927 -1.9260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6517 -0.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2359 -2.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3948 -1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1869 -2.2861 0.0000 C 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 2 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 7 13 2 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 16 2 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 14 19 1 0 0 0 0 16 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 23 25 2 0 0 0 0 10 11 2 0 0 0 0 15 16 1 0 0 0 0 13 18 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 6 2 1 5 -1 8 1 9 1 10 1 15 -1 M END