CHEMBRIDGE-ZINC02084514 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.2970 0.8640 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.0840 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -0.4240 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -0.1550 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 0.6280 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 1.1330 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -0.6860 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 0.0760 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0200 -0.5130 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 -1.8510 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3040 -2.5410 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2880 -3.8670 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -4.5270 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -3.8560 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -2.5350 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -1.9680 0.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 0.3340 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 0.4140 1.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3380 1.0180 -1.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 1.9250 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2540 3.2480 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4460 4.1650 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1330 6.5810 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8870 7.8910 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1510 7.7390 1.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2930 6.7590 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5050 5.3860 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 1.2560 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -0.1330 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.0340 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 0.8400 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 1.7310 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 1.1180 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -2.0480 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2180 -4.3800 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -5.5600 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -4.3830 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 0.8800 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3680 1.4350 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 2.0900 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 3.7330 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 3.0540 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3890 3.7280 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5320 4.3940 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8730 6.6780 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1710 6.2460 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5590 8.6660 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8580 8.2430 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5320 6.7090 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 7.0840 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 5.0450 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8090 4.6550 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2530 5.4830 -0.0500 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2740 5.7700 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END