NCI:378335 BBtclserve11129919202D 0 0.00000 0.00000188873 85961-78-0 20 23 0 0 0 0 0 0 0 0 2 V2000 3.9511 1.0789 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5388 0.2699 0.0000 Fe 0 0 0 0 0 0 0 0 0 0 0 0 4.8178 1.2301 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4049 0.7699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5388 -0.7301 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5878 0.5789 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 6.2709 0.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4049 -1.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5878 -1.0392 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 3.0000 -0.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2709 -0.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1369 0.7699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1369 -1.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0029 0.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0029 -0.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 0.7699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 -1.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7350 0.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7350 -0.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 4 7 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 14 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 9 10 1 0 0 0 0 8 11 1 0 0 0 0 15 16 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 3 5 1 6 1 9 -1 M END