NCI:332774 BBtclserve11129919062D 0 0.00000 0.00000176331 999-99-9 31 38 0 0 0 0 0 0 0 0 2 V2000 3.7997 2.2555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2997 1.3895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 0.4759 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 5.2942 1.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6361 -0.1932 0.0000 Fe 0 0 0 0 0 0 0 0 0 0 0 0 5.5021 0.3068 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6611 1.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7226 0.2135 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8440 -1.1714 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1713 1.0499 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5316 -1.1877 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 6.2453 -0.3624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4042 0.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8271 1.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0534 -0.5296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8385 -1.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2562 -1.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6935 2.9985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8760 0.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5534 -1.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1963 -0.0533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4301 2.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0181 1.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2453 -2.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6630 -2.8939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6531 0.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1467 -2.3092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2947 1.5682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1045 1.3891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6575 -2.9985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 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 9 17 1 0 0 0 0 10 18 2 0 0 0 0 10 19 1 0 0 0 0 11 20 2 0 0 0 0 12 21 2 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 24 2 0 0 0 0 16 25 1 0 0 0 0 17 26 2 0 0 0 0 19 27 2 0 0 0 0 20 28 1 0 0 0 0 22 29 2 0 0 0 0 23 30 2 0 0 0 0 25 31 2 0 0 0 0 5 6 1 0 0 0 0 12 16 1 0 0 0 0 15 20 1 0 0 0 0 13 21 1 0 0 0 0 18 22 1 0 0 0 0 27 29 1 0 0 0 0 24 30 1 0 0 0 0 26 31 1 0 0 0 0 M CHG 6 3 1 6 1 8 1 9 1 10 1 11 1 M END