CHEMBRIDGE-ZINC04030841 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 2.7860 2.0420 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 0.7020 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -0.2620 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -1.6660 1.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1570 -1.5950 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -2.9870 0.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0900 -3.5010 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -3.9900 2.1680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7270 -4.3920 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -2.5860 2.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1460 -2.7310 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -1.9790 3.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -1.4220 4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -5.0350 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 -5.5430 3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -6.5030 3.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -6.9750 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -6.4860 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -5.5240 4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -2.9480 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -3.6160 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 -3.6170 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 -2.9550 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -2.2910 1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -2.2880 1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -2.3150 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.9180 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 2.7180 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 2.5200 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 0.8800 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 0.2850 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -0.3910 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 0.2310 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -1.0080 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -1.0650 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -1.1880 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.7270 4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -0.9990 5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -2.2140 4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -0.6340 3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -5.1940 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -6.8830 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -7.7220 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -6.8530 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -5.1700 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -4.1430 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -4.1350 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -2.9550 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -1.7730 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -1.7570 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -1.7200 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -3.8240 2.0510 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4550 -3.4360 2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -4.7550 1.9390 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 30 1 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 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 52 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 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 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END