Mrv1718008251812052D 22 24 0 0 0 0 999 V2000 -1.4169 0.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1313 0.5393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1313 -0.2856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8483 0.9418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7024 0.3902 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4481 1.1751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6323 0.3914 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3769 1.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6312 -0.9434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -0.6891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4167 0.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7013 -0.9446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0678 -0.2767 0.0000 Fe 0 6 0 0 0 0 0 0 0 0 0 0 -1.4861 -0.6903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4867 0.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -1.1758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -1.1746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3468 0.9530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0613 0.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0613 -0.2845 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7782 0.9430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8483 0.0920 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 2 4 2 0 0 0 0 6 5 1 0 0 0 0 8 6 1 0 0 0 0 8 7 1 0 0 0 0 13 9 1 0 0 0 0 10 9 1 0 0 0 0 7 13 1 0 0 0 0 11 10 1 0 0 0 0 11 7 1 0 0 0 0 13 12 1 0 0 0 0 14 12 1 0 0 0 0 5 13 1 0 0 0 0 15 14 1 0 0 0 0 15 5 1 0 0 0 0 14 16 2 0 0 0 0 10 17 2 0 0 0 0 3 13 1 0 0 0 0 5 1 1 0 0 0 0 19 18 1 0 0 0 0 20 19 1 0 0 0 0 19 21 2 0 0 0 0 7 18 1 0 0 0 0 M CHG 5 5 1 7 1 13 -2 20 -1 22 1 M END