MAYBRIDGE-ZINC03128872 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 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 -1.0180 -0.3890 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.5240 1.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2830 -0.1650 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -0.0460 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -0.2550 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 -0.2450 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -0.4510 -1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -0.6680 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -0.6840 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -0.4800 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.5050 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -0.9040 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -0.4390 -0.9470 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0020 -0.2490 0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 -0.6200 -1.9530 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7670 -1.9530 1.2200 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 4.7240 -0.0760 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -0.8240 -3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.8520 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.3500 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 25 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END