CHEMBRIDGE-ZINC04670905 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0510 1.3650 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.1640 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9800 -0.5790 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.7290 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.2140 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -0.7860 3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -0.3630 3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -0.8990 2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -0.3250 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -2.4330 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.8610 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -2.3170 3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.2860 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -0.5350 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -1.1330 -3.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -0.3380 -4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -0.8830 -5.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -2.2150 -5.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -3.0160 -4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -2.4850 -3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -3.1800 -2.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -4.5910 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -5.1510 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -5.4700 -1.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -5.3530 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -5.8480 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -5.2880 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 0.1970 -7.4930 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 1.8280 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 1.7040 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.7730 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 0.8790 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -0.4830 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.4000 4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 0.7300 3.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -0.7470 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -0.6000 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -0.6890 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 0.7670 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -2.8330 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -2.8520 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -3.9540 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.7360 4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -2.6300 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -2.6150 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.7150 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 0.5260 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -1.0550 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 0.7060 -4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -2.6440 -6.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -4.0470 -4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -5.0600 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -4.8170 -2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.6380 -1.2740 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5560 -0.1620 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -1.6410 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 54 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 27 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 M CHG 1 54 1 M END