ASINEX-ZINC04908979 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.3070 1.5770 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 0.1570 -1.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.4010 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 0.2940 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -0.4040 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -1.7990 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -2.4990 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.7980 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -3.9760 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -4.5410 0.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -4.6450 0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -6.0980 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 -6.6130 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -8.1300 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -8.1110 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -6.5950 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0410 -10.0850 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -10.3970 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -9.4760 3.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 -11.7420 2.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 -12.3860 4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6330 -11.6660 5.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -12.3150 6.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9910 -13.6980 6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -14.4430 5.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -13.7940 4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -14.6300 3.2320 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3650 -15.8570 3.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 -14.0530 2.2240 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5880 1.8580 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 1.9870 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 2.0050 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 1.3780 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 0.1450 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -2.3110 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -2.3360 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -4.1180 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -6.4830 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -6.1720 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 -6.2930 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -8.4750 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -8.6120 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -8.5820 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -8.4550 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -6.2640 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -6.1560 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 -10.5810 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7620 -10.4120 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 -12.3850 2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -10.5860 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -11.7340 7.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -14.1940 7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3610 -15.5230 5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -8.5780 1.1210 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5900 -8.1630 1.7010 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 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 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 54 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 54 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M CHG 1 54 1 M END