CHEMBRIDGE-ZINC02823491 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -0.6250 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -0.1150 1.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1610 0.9710 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5000 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -0.7240 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.5180 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.1370 4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -0.3000 6.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 0.3550 7.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -0.0530 8.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 0.4430 9.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 0.0880 10.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 0.5940 12.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 1.4530 12.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 1.8080 10.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 1.3090 9.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 1.9920 13.4240 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5050 1.6800 14.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 2.7490 13.4380 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.6000 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -0.0910 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -0.2850 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -1.7140 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -0.4330 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -0.3610 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.8100 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.2120 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.6020 3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 1.2210 4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -0.1690 4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -1.3840 6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 0.0060 6.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 1.4390 7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 0.0490 7.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.5840 10.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 0.3180 13.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 2.4780 10.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 1.5900 8.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0980 2.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 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 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END