ASINEX-ZINC04309669 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.6800 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0190 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4050 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 2.0800 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 2.1930 0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8520 2.6010 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 3.2900 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 3.0040 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 1.8910 -1.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 1.2640 -0.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 -0.0940 0.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9920 -0.0520 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -0.7110 -0.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 -0.8640 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -1.8520 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6130 -2.5590 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 -2.2760 -1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 -1.2860 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 -0.5840 -1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3430 -3.2410 -2.5980 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 3.8560 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6740 3.5990 -3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 4.5530 -4.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 5.5750 -4.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 5.3640 -3.4460 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.7600 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.1590 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 3.2120 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 4.2760 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 -2.0730 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1400 -3.3310 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 -1.0650 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 0.1860 -2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 2.7230 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 4.4790 -5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 6.4070 -5.2810 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 M END