IBS-ZINC02217469 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 2.0170 0.9600 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -0.4350 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.1020 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.3880 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 1.0070 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 1.6890 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 3.1480 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 3.8930 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 3.4420 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 2.3160 -0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 4.6720 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 4.8710 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 6.1920 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 7.2550 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 7.0430 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 5.7250 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 5.2910 0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 8.1760 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 10.6370 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 11.7670 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 11.4640 -2.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 10.2770 -3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 9.0700 -2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 8.5550 -0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -2.9910 0.5590 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 1.4700 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -0.9870 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.9030 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 1.5550 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 3.6380 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 4.0350 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 6.3770 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 7.8710 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 8.5470 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 10.8330 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 10.4790 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 12.6900 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 11.9580 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 10.1190 -4.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 10.4290 -3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 8.8990 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 8.1720 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 8.5450 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 9.3450 -0.9570 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3650 9.4440 -0.9980 H 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 17 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 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 44 1 0 0 0 0 24 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END