IFLAB-ZINC04136847 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6660 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -4.0410 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -4.5740 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -3.7240 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.3310 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -1.4900 -3.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -0.5320 -3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -1.9390 -4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -3.2870 -4.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -4.2610 -3.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -5.4610 -3.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -3.7400 -5.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -2.9260 -6.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -2.2600 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -4.6970 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -5.6450 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -1.2240 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -5.0590 -6.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -5.3080 -7.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 27 28 1 0 0 0 0 M END