IBS-ZINC04811775 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0930 1.3460 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.0240 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -0.5930 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 0.2040 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 1.5810 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 2.1470 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -0.4250 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 -1.0890 -1.5710 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5150 -1.7290 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 -1.9750 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 -1.6740 -2.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 0.2540 -3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 1.7660 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 2.4010 -3.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 1.7890 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -0.6500 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -1.6650 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 2.2240 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.2150 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 0.3270 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -1.1570 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -0.0360 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -0.3440 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4740 -2.8270 -0.3980 O 0 5 0 0 0 0 0 0 0 0 0 0 4.6530 -0.0450 -2.6040 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8700 0.9080 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 -0.3960 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 2.1480 -5.0710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 25 1 M CHG 1 28 -1 M END