IBS-ZINC04733006 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 0.4610 0.3640 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -1.0530 0.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -1.9960 1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -1.5040 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.6080 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -1.0500 -2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -2.4020 -3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -3.3000 -2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.8520 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -2.8800 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -4.1320 -4.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -4.6060 -6.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3680 -3.7690 -6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -5.2240 -6.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -6.3840 -5.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -5.6600 -6.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0900 -6.4730 -5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -5.0320 -6.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -5.2060 -4.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -4.6300 -4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -3.8810 -5.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -3.7080 -6.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -4.2880 -7.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -3.2630 -5.3570 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9150 -3.4150 -4.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 -2.6040 -6.2190 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2440 -6.1740 -7.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 0.5350 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 0.9690 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.6410 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -2.0500 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -2.9830 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -1.6560 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 0.4370 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.3540 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -4.3450 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -3.5460 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -2.1850 -5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -4.4980 -6.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -5.5070 -7.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -6.8280 -5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -5.7900 -4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -4.7640 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -3.1230 -7.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -4.1560 -8.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -5.4940 -8.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 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 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 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 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END