CHEMBRIDGE-ZINC04113534 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.5100 1.4520 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.0280 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.6730 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -2.1610 1.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2780 -2.6700 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -2.7840 -0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.0060 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -2.5120 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -0.6960 -1.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -2.4040 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -2.1700 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -2.3920 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 -2.8510 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -3.0850 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -2.8550 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -3.5740 4.6580 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6160 -3.7790 5.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -3.7720 5.0460 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2350 0.0160 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 1.2280 2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.6700 3.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 0.0900 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -0.8530 5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 0.1120 7.4540 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -1.1590 8.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 2.0030 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 1.7230 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 1.6990 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -3.7330 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -0.1910 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -1.8140 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -2.2100 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -3.0330 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 0.7960 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 0.6370 4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -1.5580 6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -1.3990 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -1.6980 8.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -0.6860 9.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -1.8570 8.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 -3.0700 2.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -2.3000 3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 30 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 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END