CHEMBRIDGE-ZINC01105854 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 2.4090 2.0290 3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 0.9040 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 0.4900 1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 1.2070 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 2.2720 2.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 2.6950 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.7260 0.8670 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2680 -0.8430 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -1.9580 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -2.4810 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -1.6110 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -1.7880 0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -0.5980 0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 0.4590 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 1.6330 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 2.7360 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 3.8610 -0.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 4.0330 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 5.1920 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 5.7120 0.8890 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 4.9230 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -3.4800 2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.4690 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -3.5750 3.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -1.8300 2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -1.5010 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -0.8880 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -0.7180 2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -1.3250 1.1960 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 2.3780 4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 0.3640 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 0.8910 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 3.5710 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 0.0700 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 0.7980 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 2.0220 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 1.2940 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 2.3470 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 3.0750 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4580 3.3680 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6470 5.6260 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 5.0910 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -3.8540 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -1.7040 4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -0.5660 4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -0.2540 1.8280 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 7 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 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 2 0 0 0 0 10 11 1 0 0 0 0 10 22 2 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 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 21 42 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 M END