NCID-ZINC04962402 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.4570 1.2270 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -0.1580 0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.5660 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -1.9350 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -2.4870 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -1.6730 3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -0.3010 2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 0.2490 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -2.2660 4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -2.6580 3.8220 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -3.6550 5.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 -4.0260 5.2160 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0310 -3.1230 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 -4.9000 6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5830 -6.1250 6.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9710 -4.1740 7.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 -4.7680 8.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 -3.6980 10.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3140 -2.5050 9.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 -4.7790 4.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 -4.7450 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 -4.1000 3.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1950 -5.5830 2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6180 -5.5560 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7450 -6.3180 0.3700 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3380 -7.3320 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2010 -6.3920 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2040 -5.9040 -1.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 1.5430 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 1.3850 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 1.8330 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -2.5750 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -3.5560 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 0.3540 3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 1.3160 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -1.5650 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -3.1790 4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -3.0860 6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -4.5620 5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0640 -3.1570 7.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -5.4250 9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 -5.3740 8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -5.3550 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 -6.6150 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -5.1960 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9480 -4.5180 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3000 -5.9880 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 -4.1400 11.1870 O 0 5 0 0 0 0 0 0 0 0 0 0 12.0900 -6.8900 0.5600 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9540 -5.6130 -0.7180 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7390 -5.5440 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6830 -4.6480 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 -6.1650 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 50 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 M CHG 1 48 -1 M CHG 1 49 -1 M CHG 1 50 1 M END