ASINEX-ZINC00827257 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.9110 -0.1590 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -0.1710 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 0.7040 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 1.5890 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.5980 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 0.7220 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 2.4630 0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 3.7520 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 4.0780 0.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 4.7680 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 4.3970 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 5.3510 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 6.6750 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 7.0490 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 6.1060 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 8.7360 1.0920 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 9.5020 0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 8.7890 1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 9.1330 2.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 9.6730 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4900 10.9900 3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 10.7540 4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 10.2770 4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 8.9570 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 7.9760 0.5330 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 0.6920 -2.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 0.9120 -3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 1.2020 -3.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 0.8000 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 0.9960 -6.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 0.7880 -6.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 0.4790 -6.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 0.4810 -4.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.8370 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -0.8600 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 2.2700 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 0.7280 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 3.3650 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4110 5.0650 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 6.4000 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1570 8.9600 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 9.8540 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5130 11.3520 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 11.7300 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 9.9960 5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 11.6850 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 10.1320 5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 11.0240 4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 8.6670 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 8.1850 4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 0.5250 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 1.2600 -6.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 0.8620 -7.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 0.2600 -6.4070 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 M END