IBS-ZINC02264464 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.5750 1.7010 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 0.2180 0.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6490 -0.2410 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -0.4970 1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.8930 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -0.6050 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -0.8460 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -0.5970 3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -0.1180 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 0.1180 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.1170 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 0.1210 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -0.7970 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -1.3060 2.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -1.5110 2.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -2.0250 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -2.3550 4.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 -2.1800 3.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4820 -2.7420 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 -0.8010 3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4830 -0.8770 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0140 -1.3040 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 -1.4050 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2560 -1.0780 2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7390 -0.6420 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3590 -0.5390 4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 1.8520 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 2.1940 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 2.2160 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -1.4120 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -1.2290 4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -0.7840 4.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 0.0690 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 0.4870 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -0.5490 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -1.2800 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -0.1880 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -0.2540 4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3650 -1.5530 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8030 -1.7330 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3320 -1.1520 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4130 -0.3740 4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9800 -0.1850 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 -3.0170 4.3040 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6350 -2.6400 5.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9450 -3.0630 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 -3.9770 4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 44 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 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 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 M CHG 1 44 1 M END