CHEMDIV-ZINC01458584 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.6670 0.9050 1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -0.5120 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -1.2300 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -2.5610 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -3.1950 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -2.4860 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -1.1550 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.5780 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -5.5060 0.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -4.9060 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -6.3110 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -6.3700 -3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -7.4010 -3.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -5.0690 -3.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -4.0700 -2.6760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8150 -3.5580 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -3.0850 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -1.7160 -2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -0.7860 -2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -1.2110 -2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -2.5660 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -3.4970 -2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -4.7290 -5.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -4.7900 -5.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -4.7510 -7.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -3.8280 -7.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 -5.4370 -9.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -7.2590 -1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 0.9220 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 1.4710 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 1.4160 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -0.7590 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -3.1000 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -2.9640 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -0.6240 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -1.3560 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 0.2720 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 -0.4850 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 -2.8960 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -4.5480 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -3.7400 -5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -5.4610 -5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -5.7070 -5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -3.9530 -5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -3.7910 -7.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -5.5520 -7.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -2.9630 -8.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -3.6320 -6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 -4.1000 -8.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -6.3470 -9.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -4.6330 -9.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -5.6520 -9.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -6.3980 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -4.9980 -7.9220 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2850 -5.7870 -7.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 28 2 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 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 54 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 54 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END