CHEMDIV-ZINC01119490 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4130 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 1.8520 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 3.1030 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 3.1920 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 2.0410 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 0.7970 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 0.6870 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.4060 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 -1.8040 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -2.2830 -1.4940 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3580 -2.1160 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 -3.7760 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -4.2340 -2.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 -4.0850 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9440 -5.2760 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 -6.4720 -3.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -4.9200 -3.6650 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -5.7300 -4.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -5.4260 -2.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -3.6190 -4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -3.2540 -5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -2.2340 -6.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -1.5770 -5.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.9420 -4.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -2.9660 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -0.1800 -6.5480 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -1.5540 -2.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7690 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 4.0010 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 4.1610 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 2.1200 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 -0.0930 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -1.8890 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 -2.4190 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 -3.9430 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -4.3320 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 -4.0470 -4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 -3.1630 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 -5.1220 -3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -5.3660 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 -7.2690 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -3.7670 -6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -1.9490 -7.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.4300 -3.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -3.2540 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -1.6560 -1.7200 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 32 54 1 0 0 0 0 M END