SIAL-ZINC04535657 MOE2007 3D CORINA 3.40 0006 02.08.2006 87 89 0 0 1 0 0 0 0 0999 V2000 -0.5330 2.4270 -2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 0.9140 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 0.4150 -1.4270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7070 0.8560 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 0.8960 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -1.1320 -1.5300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1360 -1.5480 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -1.6800 -2.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -0.9810 -3.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -3.0630 -3.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -3.8460 -4.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3660 -3.2560 -5.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -5.0450 -3.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -5.9990 -3.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -4.8760 -4.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -5.8100 -4.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1350 -5.4120 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -5.6950 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -5.2380 -2.2980 O 0 0 0 0 0 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1 0 0 0 0 26 31 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 34 35 2 0 0 0 0 34 87 1 0 0 0 0 36 37 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 37 38 2 0 0 0 0 37 42 1 0 0 0 0 38 39 1 0 0 0 0 38 73 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 41 42 1 0 0 0 0 41 46 2 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 43 74 1 0 0 0 0 44 45 2 0 0 0 0 44 75 1 0 0 0 0 45 46 1 0 0 0 0 45 76 1 0 0 0 0 46 77 1 0 0 0 0 47 48 1 0 0 0 0 47 78 1 0 0 0 0 47 79 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 80 1 0 0 0 0 49 81 1 0 0 0 0 49 82 1 0 0 0 0 49 83 1 0 0 0 0 50 84 1 0 0 0 0 50 85 1 0 0 0 0 50 86 1 0 0 0 0 M CHG 1 87 -1 M END