NCID-ZINC06004945 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.1400 1.6360 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 0.2510 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -0.6290 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -0.0810 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 1.2880 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 2.1650 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 1.5600 -0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3460 1.9370 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 0.1300 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -0.1830 -0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -0.7530 -0.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 2.4790 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 3.1950 -1.1520 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 4.0430 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 4.7870 -2.9810 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4370 5.5570 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 5.4580 -4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 4.8570 -5.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 6.7540 -4.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6110 7.5850 -5.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 8.9560 -5.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 9.1250 -3.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4640 3.8960 -2.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7160 4.3360 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 5.4870 -2.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7490 3.2260 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1200 3.6930 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1420 2.5670 -2.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2050 2.0270 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5600 3.0400 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9180 2.3510 -0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 2.3010 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -0.1370 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.6970 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 3.2330 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -1.7560 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 1.9310 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 3.3170 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 3.2890 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 4.7470 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 7.2410 -3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5890 7.7250 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 7.0450 -6.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3300 2.9360 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3750 2.4050 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8250 2.8580 -3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4820 4.4900 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0270 4.1520 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 9.7220 -6.1540 O 0 5 0 0 0 0 0 0 0 0 0 0 15.1250 3.9300 -2.3370 O 0 5 0 0 0 0 0 0 0 0 0 0 12.7380 1.5400 -1.0340 N 0 3 0 0 0 0 0 0 0 0 0 0 12.5730 0.6000 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0250 1.8420 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6620 1.5180 -0.4880 H 0 0 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 51 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 M CHG 1 49 -1 M CHG 1 50 -1 M CHG 1 51 1 M END