CHEMBRIDGE-ZINC00298500 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 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 3 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -1.7020 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -2.1600 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.4190 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -0.2200 3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 0.2400 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -0.8270 1.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.6570 -1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -1.1420 -1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -1.2690 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 -1.7790 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 -1.9170 -3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4410 -2.3950 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0400 -2.7380 -2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3460 -2.6040 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -2.1330 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8140 -3.3920 -2.2050 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 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 1.4330 -2.2800 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -3.0960 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -1.7770 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 0.3580 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 1.1780 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -0.4160 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -1.0000 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6820 -1.6490 -4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9880 -2.5010 -4.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8190 -2.8730 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 -2.0330 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -1.4280 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 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 30 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 21 36 1 0 0 0 0 M END