CHEMSTAR-ZINC04142034 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.2520 1.3750 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.0060 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.6800 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 0.0370 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 1.4180 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.0860 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 2.1830 -1.5390 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9290 1.5950 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 3.4010 -1.5260 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2370 -2.0790 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.7720 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -2.1860 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -4.2750 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -4.7750 0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -6.1210 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 -6.6710 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -8.0370 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -8.8660 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -8.3100 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -6.9440 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -10.3340 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -11.1960 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -12.5690 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -12.2980 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -10.8990 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -10.0620 2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 -9.3980 3.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -12.8710 2.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -13.4880 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -14.8660 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -15.7180 -1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -15.2050 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -13.8370 -2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -12.9770 -1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -16.3780 -3.9480 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.9000 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -0.5620 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -0.4840 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -2.5500 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -4.6920 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -4.5650 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -6.0290 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -8.4650 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -8.9490 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -6.5120 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -10.8010 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -12.3080 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -13.8350 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -15.2680 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -16.7860 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -13.4420 -3.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -11.9090 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -13.0700 0.9390 N 0 0 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 25 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 29 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 54 2 0 0 0 0 25 26 1 0 0 0 0 26 27 3 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END