NCID-ZINC05957581 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 0.2470 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -1.8490 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -2.2790 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -3.8080 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5120 -4.2050 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -4.2890 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8150 -4.5490 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 -5.5430 0.8370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8610 -6.4230 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -5.6720 1.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5640 -6.3560 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -4.3370 1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -6.1350 2.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -7.3940 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -7.3710 4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -8.5540 5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -8.5800 6.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -9.6560 4.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -10.4790 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -9.6160 3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -8.5220 2.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -10.7500 2.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -6.1190 4.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -5.3880 3.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 -3.5660 3.8160 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 -5.3510 1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -6.4460 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -7.5290 1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0760 -6.3250 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 -7.7090 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -5.7340 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 -3.2690 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -2.3920 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -2.4750 -1.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8830 -1.3050 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2980 -0.4510 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1250 -1.9360 0.6490 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -1.9010 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.8910 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -11.5640 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -10.7360 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9010 -5.6720 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7980 -8.3620 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3220 -7.6220 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1350 -8.1300 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 -6.3870 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9670 -4.7480 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 -5.6460 5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3800 -0.6780 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8000 -1.0780 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 0.3350 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4120 -0.0020 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8300 -2.5450 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8040 -1.1500 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 -2.5640 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 3 48 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 49 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 60 1 0 0 0 0 40 61 1 0 0 0 0 40 62 1 0 0 0 0 40 63 1 0 0 0 0 41 64 1 0 0 0 0 41 65 1 0 0 0 0 41 66 1 0 0 0 0 M END