Ketcher 11121820432D 1 1.00000 0.00000 0 43 46 0 0 0 999 V2000 4.7147 2.4412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6657 2.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4057 1.4902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1269 3.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6657 3.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5318 2.2502 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4545 1.1811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9935 0.6811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7147 4.0593 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5318 4.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3979 2.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4545 0.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4057 -0.1279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9935 0.6811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3979 3.7502 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5318 5.2502 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6456 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7147 -1.0789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5411 -0.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4545 -0.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6625 0.7970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3206 -0.6811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0638 -0.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4251 -1.6758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 1.7675 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0419 -0.2199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8661 -1.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8659 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8659 -0.5000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.8661 0.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8661 -0.5000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 0.8659 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 1.7675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 2.6335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6570 2.6335 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1571 3.4995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6571 4.3656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1572 3.4994 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 -5.1571 3.4995 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 3 1 1 1 0 0 1 4 1 0 0 0 2 5 2 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 4 9 2 0 0 0 5 10 1 0 0 0 6 11 2 0 0 0 7 12 1 0 0 0 8 13 1 0 0 0 8 14 1 6 0 0 10 15 2 0 0 0 10 16 1 0 0 0 12 17 1 1 0 0 13 18 1 6 0 0 17 19 1 0 0 0 20 21 1 0 0 0 22 21 1 6 0 0 22 23 1 0 0 0 22 24 1 0 0 0 23 25 1 0 0 0 24 26 1 0 0 0 24 27 1 1 0 0 25 28 1 0 0 0 26 29 1 1 0 0 5 9 1 0 0 0 11 15 1 0 0 0 12 13 1 0 0 0 25 26 1 0 0 0 19 35 1 0 0 0 35 30 1 0 0 0 30 33 1 0 0 0 35 31 2 0 0 0 33 20 1 0 0 0 33 32 2 0 0 0 33 34 1 0 0 0 35 36 1 0 0 0 28 37 1 0 0 0 38 37 1 0 0 0 38 39 1 6 0 0 38 40 1 0 0 0 40 41 2 0 0 0 39 42 1 0 0 0 40 43 1 0 0 0 M CHG 2 34 -1 36 -1 M END