Ketcher 04271513502D 1 1.00000 0.00000 0 22 24 0 0 0 999 V2000 6.2498 -5.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4588 -5.9760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4588 -6.8895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6650 -5.5303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0409 -6.1411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3225 -5.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5190 -6.1398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2361 -5.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5177 -7.6178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3867 -7.3363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3875 -6.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0422 -7.6191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7436 -6.8796 0.0000 Fe 0 0 0 0 0 0 0 0 0 0 0 0 6.1732 -7.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1725 -6.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4347 -7.8751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1253 -7.8738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3101 -5.5180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1012 -5.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1012 -6.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8949 -5.5290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9725 -6.4713 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 2 4 2 0 0 0 6 5 1 0 0 0 8 6 1 0 0 0 8 7 1 0 0 0 13 9 1 0 0 0 10 9 1 0 0 0 7 13 1 0 0 0 11 10 1 0 0 0 11 7 1 0 0 0 13 12 1 0 0 0 14 12 1 0 0 0 5 13 1 0 0 0 15 14 1 0 0 0 15 5 1 0 0 0 14 16 2 0 0 0 10 17 2 0 0 0 3 13 1 0 0 0 5 1 1 0 0 0 19 18 1 0 0 0 20 19 1 0 0 0 19 21 2 0 0 0 7 18 1 0 0 0 M CHG 5 5 1 7 1 13 -2 20 -1 22 1 M END