CHEMBRIDGE-ZINC00646222 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0230 1.5020 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.7550 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.1330 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.9830 1.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.5690 3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -1.2540 3.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.3100 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 0.8750 2.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.8550 4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -0.6900 5.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -0.8860 4.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.3240 6.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -0.1640 7.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 0.2520 8.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 0.4170 9.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 1.6450 8.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 1.7960 9.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1940 0.7200 9.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 -0.5070 10.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2610 -0.6570 9.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.4340 -0.7900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.7140 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.1340 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 1.0740 -2.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.9390 -3.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -0.3910 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 0.8410 -5.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 1.3800 -6.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 0.6940 -7.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.5330 -7.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -1.0800 -5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 1.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.8600 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8500 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -3.3010 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 0.0900 5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -1.6230 5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -0.1680 7.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -1.1090 7.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 0.6040 6.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 1.1970 8.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -0.5160 9.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 2.4850 8.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 2.7550 9.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2150 0.8380 10.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 -1.3480 10.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -1.6150 9.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.8990 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.3780 -4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 2.3380 -6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.1170 -8.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -1.0660 -7.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -2.0410 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 23 2 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END