KEYORGANICS-ZINC04014656 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.6750 0.1200 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 0.1610 -1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -0.7540 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -1.7250 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.7530 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.8370 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -2.7140 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -2.0430 -1.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -2.8300 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -4.0090 -2.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 -2.1070 -2.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 -2.5920 -2.8000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3630 -3.3710 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 -1.4820 -2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1190 -0.7790 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1810 -0.8490 -0.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0640 -3.1990 -4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5750 -4.4880 -4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5510 -5.0580 -5.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 -4.3380 -6.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 -3.0550 -6.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 -2.4880 -5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -5.1130 -8.4850 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 0.8340 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 0.9070 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -0.7070 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -2.4870 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -0.8670 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -3.5360 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -3.1310 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 -1.1520 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -1.8930 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9670 -0.7170 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 -5.0610 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 -6.0590 -5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 -2.4890 -7.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 -1.4870 -5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 -0.2030 -1.1470 O 0 5 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 38 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 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 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 36 1 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 38 -1 M END