IBS-ZINC06670030 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -0.6790 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -0.4760 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -1.1550 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -1.3880 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -1.8330 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -2.0480 -4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -1.8200 -4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -1.3730 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -1.1330 -3.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.7050 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -0.5110 -2.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -1.3530 -4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -2.7740 -4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -3.0840 -4.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -4.3860 -4.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -5.3800 -4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -5.0690 -5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -3.7650 -5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -7.1620 -4.6430 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 -1.2210 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 -2.0150 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -2.3970 -5.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -1.9900 -5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -0.6680 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -1.1750 -5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -2.3080 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -4.6290 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -5.8450 -5.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -3.5220 -5.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 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 M END