IBS-ZINC04870528 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 1.6390 2.3000 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 1.3030 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 3.6280 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 3.5930 2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 5.0090 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 5.0100 3.8850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 5.2400 5.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6800 6.1450 5.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 5.5620 5.7190 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5030 4.9760 4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 4.7780 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 4.4870 2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6980 4.7520 4.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 5.0910 7.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 4.1870 7.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 5.7110 8.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 4.9820 9.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 5.4980 10.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 6.7410 10.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 7.4800 9.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 6.9680 8.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 7.2360 11.6590 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 4.0740 6.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 2.7780 6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 1.7410 6.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 1.9790 7.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 3.2580 7.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 4.2930 6.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 3.6280 8.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 2.6910 9.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 1.2830 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 2.7330 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.9160 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.7430 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 0.3460 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 1.1510 2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 4.2450 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 4.0180 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 3.0420 2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 3.0560 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 5.5490 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 5.5640 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 6.6400 5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 4.0050 9.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 4.9370 11.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 8.4540 9.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 7.5780 7.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 2.5560 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 0.7430 6.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.1460 8.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 5.2850 6.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 1.8100 8.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 3.1730 9.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 2.4080 9.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 2.2400 1.1340 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1340 1.8350 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END