CHEMBRIDGE-ZINC01134458 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.3180 1.2680 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.1100 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -0.7550 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -0.0220 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.3570 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 2.0130 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 3.4900 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 4.0650 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 4.2000 0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 5.6660 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 6.2450 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 5.6420 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 4.1250 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 3.5210 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 6.2350 -1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0660 7.0590 -2.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7910 5.8490 -1.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6540 6.4770 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4120 7.7860 -3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2620 8.4060 -4.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3580 7.7250 -4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6040 6.4130 -4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7540 5.7940 -3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7300 5.9700 -4.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4000 7.1560 -5.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3320 8.1050 -5.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -2.2340 0.1140 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5560 -2.8810 -0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -2.8040 0.7890 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4260 1.7700 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -0.6880 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -0.5310 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 1.9270 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 6.0160 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 5.9840 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 6.0030 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 7.3280 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 5.8630 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 3.9030 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 3.6980 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 3.6680 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 2.4560 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1210 5.1370 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 8.3180 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 9.4240 -4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9460 4.7770 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1110 7.5130 -4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9020 6.9630 -6.2950 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 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 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 15 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END