ASINEX-ZINC05043446 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.1220 0.7450 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.6110 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -1.1150 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -0.2660 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 1.0970 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 1.5980 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -0.8400 0.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8970 -1.8340 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -0.8870 -1.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7800 -0.5780 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 0.0570 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1220 0.5690 0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -0.0950 0.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 0.3400 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -0.8070 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -0.3250 4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 -1.1220 6.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 -2.3180 7.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6670 -2.7110 7.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0340 -3.1120 6.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8590 -1.9610 5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 -0.7890 -2.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -2.2330 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -3.2350 -1.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -2.3310 -3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -3.4900 -4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -3.2640 -5.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -1.9380 -5.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -0.9820 -4.5990 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 1.1370 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -1.2750 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -2.1790 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 1.7810 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 2.6550 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5260 1.1550 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 0.7390 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 -1.6140 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 -1.2240 2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 0.4420 4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 0.0770 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -0.8560 6.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -0.2580 7.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 -2.0480 8.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -3.1720 7.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0850 -3.4190 6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 -3.9850 6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4840 -1.1030 5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0860 -2.2950 4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -0.0730 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -4.4640 -3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -4.0350 -6.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -1.4850 -6.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 -1.4790 5.4600 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8100 -2.2650 5.1740 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 53 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 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END