Mrv1718007111813112D 16 12 0 0 0 0 999 V2000 0.4125 0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.1432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -1.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -0.2858 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7714 0.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3589 -0.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3589 1.1432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7714 -1.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5339 -0.2858 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0000 -3.4753 0.0000 Fe 0 2 0 0 0 0 0 0 0 0 0 0 2.8286 -2.6503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8286 -4.3003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0036 -3.4753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6536 -3.4753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8286 -3.4753 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 2 2 0 0 0 0 5 2 1 0 0 0 0 7 6 1 0 0 0 0 8 6 1 0 0 0 0 9 7 2 0 0 0 0 10 7 1 0 0 0 0 16 12 1 0 0 0 0 16 13 1 0 0 0 0 16 14 2 0 0 0 0 16 15 2 0 0 0 0 M CHG 3 5 -1 10 -1 11 2 M END