IBS-ZINC02095440 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 67 0 0 1 0 0 0 0 0999 V2000 -0.7130 1.7680 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 0.3910 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.2390 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 0.5090 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 1.8870 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 2.5160 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -0.1770 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -0.5280 -1.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 0.3100 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 1.6130 -2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 2.2420 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 1.5920 -4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 0.3040 -4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -0.3460 -3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -1.6900 -3.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -2.5640 -4.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 -1.7530 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.7740 -1.7830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -2.6020 -0.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -3.6320 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -4.7090 -0.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -5.5050 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -6.7500 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -7.2560 0.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -6.6100 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -5.4410 2.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -4.8580 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -3.6820 1.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -2.6690 2.2250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4110 -3.0680 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -1.4020 1.8760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2450 -1.3360 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -0.2390 2.3620 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0880 0.4030 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.9400 2.9490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9410 -1.0720 4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -2.2250 2.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -0.1320 2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 -0.7430 3.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 0.5200 3.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -1.4020 2.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -7.4350 -1.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 2.4760 -6.1630 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 2.2610 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 -0.1940 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -1.3150 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 2.4720 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 3.5930 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 0.4930 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -1.0830 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 2.1300 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 3.2520 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 -0.2020 -5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -1.7600 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -7.0570 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -0.1080 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 0.8850 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 -0.2830 3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 1.2630 3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -0.6280 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -7.0550 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -8.2940 -1.4260 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 44 1 0 0 0 0 2 3 2 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 6 48 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 17 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 52 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 37 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 41 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 40 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 38 39 1 0 0 0 0 38 56 1 0 0 0 0 38 57 1 0 0 0 0 39 58 1 0 0 0 0 40 59 1 0 0 0 0 41 60 1 0 0 0 0 42 61 1 0 0 0 0 42 62 1 0 0 0 0 M END