CHEMBRIDGE-ZINC03945137 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6920 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0970 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7440 2.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7180 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.6870 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9800 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6620 -1.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6170 -2.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -1.8680 -3.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.4720 -4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -1.6840 -5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -2.3300 -7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -1.5870 -8.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.2040 -8.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.4430 -7.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.2880 -5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 0.8060 -9.9270 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1650 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.5860 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -3.5510 -4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.4090 -7.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -2.0860 -9.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.5220 -7.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 0.2180 -4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 23 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 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 M END