IBS-ZINC05160665 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 1.9770 1.2110 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.2130 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -0.9510 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -2.2460 1.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -3.4220 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -4.5660 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -4.5510 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -3.4190 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -2.2050 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -0.9950 0.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -0.5580 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -1.3120 2.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 0.8000 3.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2850 1.2190 3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 2.0010 5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 2.6250 5.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 1.8710 5.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 0.9540 4.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9020 1.4680 3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -0.3320 5.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -1.1780 5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -2.3650 6.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -2.7230 6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -1.8930 5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -0.7040 4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.5600 6.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.8850 7.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 2.7160 8.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 0.8140 10.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 3.1280 11.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 1.0600 3.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 1.8560 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 1.3910 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 1.5020 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -3.3770 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -5.4990 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -5.4850 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -3.4070 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -0.9360 5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -3.0160 6.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -3.6520 6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -2.1750 5.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 -0.0810 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 2.6220 6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 3.5820 6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 1.7420 7.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 0.8890 7.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 2.7560 8.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 3.7360 8.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 0.9380 10.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 0.0820 9.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 0.5000 11.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 4.0370 11.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 3.3350 11.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 2.6890 12.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 1.5790 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 2.1400 10.2210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4050 1.9800 10.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 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 13 18 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 57 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 57 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END