CHEMDIV-ZINC02452479 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.1620 1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -0.0510 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 0.3080 2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 0.5640 3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 0.9060 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 1.0030 4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1730 0.7590 3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 0.4060 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 0.1570 1.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -0.1730 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -0.2720 0.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3090 -0.4400 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -0.3410 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4190 -0.5900 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 -0.9390 -3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 -1.0390 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -0.7860 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7550 -1.2800 -4.7940 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -2.4350 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 0.0060 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 0.4920 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 1.1040 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 1.2740 5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2500 0.8380 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2120 -0.0700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4960 -0.5140 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8750 -1.3120 -4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 -0.8600 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 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 M END