CHEMBRIDGE-ZINC01139503 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2090 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0170 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.3960 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5630 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 4.3690 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 5.6910 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 5.6360 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 4.3370 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 6.7860 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 7.9170 0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 6.5930 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 7.7440 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 7.3320 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 8.5340 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 9.0190 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 7.8910 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 6.6890 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 6.2040 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 7.1000 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 8.2290 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 9.4300 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.5740 -0.0220 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -0.5190 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 1.9400 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 4.0460 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 6.5830 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 5.6920 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 8.5480 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 6.9870 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 8.2410 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 9.3380 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 9.8750 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7920 7.5980 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 8.2360 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 5.8850 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 5.3480 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6150 5.9110 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 6.2440 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 7.4460 -3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 8.5220 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 9.7760 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 10.2340 -0.7670 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 32 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 M END