CHEMBRIDGE-ZINC02990994 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0700 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -3.0040 -2.8540 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1300 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -4.7960 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -6.3100 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -6.7050 1.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -8.1080 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -8.4150 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -8.1200 3.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -8.3380 4.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -8.8190 5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -9.0480 6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -8.8000 7.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -8.3060 7.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -8.0650 6.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -7.5890 5.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -7.3320 6.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -7.5420 8.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -8.0360 8.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8400 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -4.5150 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -4.5060 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -6.8170 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -6.5800 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -8.6520 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -8.4160 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -9.4690 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -7.8030 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -9.0240 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -9.4290 6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -8.9840 8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -6.9490 6.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -7.3200 9.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -8.2050 9.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.0360 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -3.7850 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -2.2470 3.2510 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 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 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END