IBS-ZINC00646899 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 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 0.0240 -0.8250 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1240 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1090 -0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.8870 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7690 -1.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.1760 1.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.9300 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -1.6920 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.4490 2.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7380 0.2950 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 0.1090 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -0.6680 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -0.1590 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 1.1290 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 1.9120 3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 1.4020 3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 2.1690 3.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 2.1000 4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 3.0100 4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 2.5270 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 3.3620 4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 4.6800 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 5.1630 5.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 4.3270 5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 5.8220 4.7220 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 3.1790 4.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 3.6380 4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -1.5560 4.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -1.4470 5.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -4.0000 3.6670 N 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 2.4360 -1.6740 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -0.7690 3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 1.5240 3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 1.0760 5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 2.4150 5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 1.4980 4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 2.9840 4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 6.1920 5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 4.7020 5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 4.6610 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 2.9940 5.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 3.6090 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -4.9010 3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -3.8550 4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 28 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 3 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 M END