Ketcher 09082013362D 1 1.00000 0.00000 0 49 51 0 1 0 999 V2000 10.1396 -6.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1396 -7.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1396 -8.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2772 -6.9832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2772 -8.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4149 -7.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4149 -8.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2772 -10.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5500 -6.9882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5525 -8.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4149 -10.5072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5525 -7.9993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5525 -10.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6901 -8.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4149 -11.5058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6901 -10.5072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8276 -8.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8276 -10.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9628 -10.5022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2772 -7.9993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4149 -9.4936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1396 -9.4936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0988 -8.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6916 -7.9906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0989 -7.1746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0989 -6.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9637 -6.6766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9637 -5.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2340 -5.6778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8286 -6.1759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6959 -5.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5609 -6.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6959 -4.6791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4256 -5.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2905 -6.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1554 -5.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0203 -6.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8852 -5.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7501 -6.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6149 -5.6778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.4798 -6.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6149 -4.6791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3446 -5.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2096 -6.1759 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 24.0745 -5.6778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7501 -7.1742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.7086 -7.0403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.7104 -7.0403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.8850 -5.7660 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 2 4 1 0 0 0 5 3 1 0 0 0 3 22 1 6 0 0 6 4 1 0 0 0 7 5 1 0 0 0 5 8 1 0 0 0 5 20 1 1 0 0 7 6 1 0 0 0 6 9 1 1 0 0 7 10 1 0 0 0 7 21 1 6 0 0 11 8 1 0 0 0 10 12 1 1 0 0 10 13 1 0 0 0 10 14 1 0 0 0 11 13 1 0 0 0 11 15 1 6 0 0 13 16 2 0 0 0 14 17 2 0 0 0 16 18 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 3 23 1 0 0 0 3 2 1 0 0 0 23 24 1 0 0 0 2 25 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 25 27 1 6 0 0 26 28 1 0 0 0 26 29 2 0 0 0 28 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 31 33 2 0 0 0 32 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 40 42 1 0 0 0 41 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 39 46 2 0 0 0 44 47 2 0 0 0 44 48 2 0 0 0 M CHG 2 45 -1 49 1 M END