CHEMBRIDGE-ZINC04913330 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 1.0850 1.7220 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 0.2740 -0.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4510 0.2560 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -0.3280 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -2.5230 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -1.8430 -1.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2580 -2.2770 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -0.4440 -1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -2.0820 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -2.4760 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.1380 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.5190 3.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -2.6240 4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -3.3250 4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -3.5200 5.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -2.9980 6.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.2780 6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -2.0900 5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -3.2060 7.4610 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6430 -3.8780 7.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 -2.6990 8.5720 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1730 1.7910 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 2.1480 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 2.3350 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -0.2860 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 0.1740 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -3.5650 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -2.4790 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -1.7240 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -1.5470 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -3.1490 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -2.1760 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -3.5550 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -2.7060 4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -1.0670 3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -3.7350 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -4.0780 4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -1.8580 7.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -1.5170 5.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -1.8000 1.2200 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1550 -1.8730 1.2810 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