IBS-ZINC02223560 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -4.8550 1.5480 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 0.0390 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -0.2340 -2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -0.5140 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -2.0150 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -2.5860 -1.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -2.7240 -0.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 -4.1240 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -4.8440 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -6.2220 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -6.9000 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -6.1810 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -4.7850 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -7.0990 -0.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 -8.2970 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -8.2100 -0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -9.5590 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 -10.7850 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 -11.9600 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5230 -11.9280 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1940 -10.7110 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 -9.5310 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0840 -10.6740 -0.3130 Br 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 -13.0890 -0.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 1.9420 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 1.7430 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 2.0330 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 -0.4460 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -1.3090 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 0.1600 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 0.2510 -3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -0.0950 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -0.2420 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -2.2640 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -4.3190 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -6.7740 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -4.2250 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -10.8110 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -12.9080 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0040 -8.5850 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4330 -13.4430 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 24 41 1 0 0 0 0 M END