IFLAB-ZINC04279534 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 4.3840 2.0150 -4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 0.6590 -4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -0.2960 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 0.0940 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 1.4530 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 2.4200 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 3.7750 -2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 4.2450 -1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 5.7750 -1.6040 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5320 6.1060 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 6.3450 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 8.5210 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 10.0490 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 9.8090 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 8.2910 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 12.0370 0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 12.4020 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 11.4820 2.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 11.7810 3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 6.2950 -2.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 7.2020 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -2.1350 -4.1310 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 2.7620 -5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 0.3670 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -0.6480 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 1.7190 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 3.9110 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 3.8610 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 5.8950 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 6.0620 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 8.2210 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 8.2600 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 10.5380 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 10.3640 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 10.1070 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 10.1400 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 8.0210 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 7.8050 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 12.3730 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 12.4500 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 13.4270 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 12.2870 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 7.8160 -0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 10.5280 0.7230 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7260 10.3210 1.4250 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 43 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 44 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END