NCID-ZINC04544781 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 46 0 0 1 0 0 0 0 0999 V2000 0.2970 1.1960 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -0.3070 0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3850 -0.7330 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.5950 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -1.0360 1.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -0.2950 -0.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -0.4740 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 0.0410 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 0.4600 -3.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 -0.0110 -2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 0.3900 -3.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9230 1.3360 -3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -0.6810 -4.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8730 -1.9150 -4.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8820 -1.8050 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7860 0.6120 -3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1470 0.3920 -1.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6370 0.9910 -4.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0620 0.6380 -4.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.4240 0.8950 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8800 1.3850 -5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9860 2.8890 -4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8430 3.6520 -5.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7890 3.2340 -7.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2700 -0.9140 -4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2160 -1.5800 -4.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.9840 1.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -1.2290 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -0.9270 0.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 1.4200 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 1.7000 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.6390 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 0.0640 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -1.5390 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 0.0820 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1610 -0.3350 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 -0.3380 -5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -0.9020 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2920 1.4400 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4290 1.2190 -6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8950 0.9730 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4090 3.0430 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9900 3.3460 -4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -1.2880 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -1.7520 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4880 4.6340 -5.3560 O 0 5 0 0 0 0 0 0 0 0 0 0 -11.4500 -1.3320 -4.0210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 M CHG 1 46 -1 M CHG 1 47 -1 M END