IFLAB-ZINC02451758 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 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 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -1.2300 0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -1.2460 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -1.6130 0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -1.5710 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -0.8630 3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -0.2080 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 0.4630 2.7300 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 2.2710 -2.6470 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -1.1690 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.5870 4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -0.1090 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -0.2070 -0.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -0.5660 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 20 21 1 0 0 0 0 M END