CHEMDIV-ZINC01065631 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8480 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -2.3970 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -3.7690 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5960 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.0510 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -2.6790 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -6.3450 -0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -6.8940 0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -6.6000 0.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -6.8240 -1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -7.1960 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -6.8440 -3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -7.3570 -4.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -6.9120 -2.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8820 -5.9490 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -7.9810 -1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -7.8590 -1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4370 -8.8380 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8690 -9.9440 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -10.0650 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -9.0850 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -11.5710 0.2500 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.6640 -10.9080 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0760 -10.7180 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -1.7520 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.1970 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.6980 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.2540 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -6.6500 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -8.2670 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -5.7760 -4.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -7.4300 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0680 -6.9970 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5110 -8.7420 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -9.1800 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5920 -11.5580 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3580 -9.7940 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3560 -10.6580 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END