IBS-ZINC02354427 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.6560 2.0560 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 0.7330 1.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.2860 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -1.5330 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -1.7230 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -2.8070 0.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.6930 -0.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 0.5090 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.4160 -0.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -0.8860 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -2.3450 2.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -1.5810 3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -0.3660 3.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -2.0100 5.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -1.0320 6.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -1.7670 7.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -0.7460 8.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -1.4490 9.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -1.8110 10.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -2.4310 11.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -2.4480 11.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -1.8570 10.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -3.7520 3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -3.8420 3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -4.3930 2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 -4.4750 2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -4.0080 4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -3.4570 5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -3.3800 4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -2.6960 5.8310 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -4.9790 1.0450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 2.1000 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 2.8180 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 2.2340 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -0.6500 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -0.2290 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.9240 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -2.9590 5.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -0.3850 5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -0.4300 6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -2.4150 7.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -2.3690 7.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -0.0980 8.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.1440 8.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 -1.6330 9.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -2.8430 12.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -1.7180 10.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -4.2640 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -4.2220 3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -4.9040 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7350 -4.0720 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -3.0920 5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 M END