MMs02447529 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9012 -1.1991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3133 -2.5791 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1549 -2.2718 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9996 -1.6922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4622 -3.7399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -4.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8268 -5.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8874 -4.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0052 -3.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6978 -1.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2727 -1.2715 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4303 -3.6755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5481 -2.6753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9733 -3.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2806 -4.6114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0911 -2.1429 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1947 -5.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6199 -6.1440 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8132 -2.5941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5762 -1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8392 0.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0761 -1.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8391 -0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 -0.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 1.2502 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7020 2.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6019 1.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3389 -0.0713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9593 0.7209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7209 0.9593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4796 -0.3605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8972 -1.7012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8685 -0.5516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8637 -4.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3736 -4.4172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8452 -0.9684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2312 -2.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4028 -3.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8559 -2.4973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1996 -1.7394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7156 0.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0593 1.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1188 -1.2209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4625 -0.4629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0769 -6.6763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3649 2.5267 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3650 2.5567 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4102 3.1463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7755 3.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3198 1.9672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 2 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 46 2 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 48 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 47 -1 M CHG 1 48 1 M END