CHEMBRIDGE-ZINC04913326 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.4530 1.4310 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -0.0490 -0.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4510 -0.5770 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -0.6060 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -2.1500 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -1.5200 0.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7860 -1.4420 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -0.1750 0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -2.3640 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -2.6860 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -4.2110 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -4.5250 1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -5.8120 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -6.0010 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -7.2630 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -8.3480 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -8.1760 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -6.9070 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -9.6740 0.0320 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7040 -9.7770 -0.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -10.6130 0.7620 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5240 1.6000 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 1.8270 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 2.0130 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -0.5820 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -0.0670 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -1.6060 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -3.2050 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -3.3380 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -1.8530 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -2.5400 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -2.3590 3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -2.2950 2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -4.6050 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -4.6360 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -5.1560 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -7.3740 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -9.0120 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -6.8110 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -2.0590 1.3170 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7810 -2.5990 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 26 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 40 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 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 40 1 M END