CHEMBRIDGE-ZINC02682853 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.4430 2.0420 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 1.4900 2.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 0.6290 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 0.3330 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 0.8790 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 1.7360 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 0.5040 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -0.6740 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 1.5380 1.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 1.3000 0.8720 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5270 0.5110 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 2.5730 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1780 3.9350 1.4320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 2.2880 -0.2090 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 3.0980 -1.2190 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 0.8000 2.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 -0.3230 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 -1.3370 0.9240 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 -0.4250 3.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 -1.5190 4.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 -1.2140 5.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0960 -2.2230 6.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0010 -3.5720 5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3920 -3.8750 4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8940 -2.8620 3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5320 -4.6650 6.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0360 -4.3030 7.9840 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8680 -0.5100 0.0390 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3530 -1.6350 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -0.0140 -0.9580 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3220 2.7050 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 1.7320 3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 0.2070 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 2.1490 3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 2.4910 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 1.3230 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 0.4420 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 -0.1840 5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5600 -1.9560 7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 -4.9170 4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3880 -3.1740 2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4380 -5.8640 6.4600 O 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 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 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 2 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 1 M CHG 1 30 -1 M END