CHEMBRIDGE-ZINC04020593 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.6020 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9910 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8280 -0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3680 -2.1910 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -3.7800 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -5.1180 -0.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -4.9820 0.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -3.7540 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -3.3260 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -4.1590 1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -3.5140 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -2.1800 2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -1.6570 1.4760 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -6.3270 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -7.5310 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -8.7260 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -8.7260 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -7.5290 -1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -6.3310 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -10.3640 -1.6650 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2390 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1430 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -2.3140 -4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -3.6800 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -3.6180 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -3.6490 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -5.2350 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 -4.0490 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -1.5190 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -7.5320 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -9.6610 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -7.5330 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -5.3980 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END