IBS-ZINC02105768 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 1 0 0 0 0 0999 V2000 -0.6430 0.7580 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -0.7560 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -1.0690 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -1.2430 1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -1.5330 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -1.6440 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -1.4680 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -1.1750 3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -0.9970 3.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 -1.1200 4.8430 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0830 -0.4410 5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -0.7670 4.9660 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3220 0.2430 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 -1.7620 4.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7130 -1.6730 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -3.1830 4.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9900 -3.2860 5.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -3.4430 4.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8680 -3.3790 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -2.4640 5.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -4.8390 5.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -5.1270 4.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 -4.1250 3.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3710 -1.4840 4.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -0.8360 6.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -1.9260 4.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -1.7200 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 -0.9040 2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 -1.4560 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 -2.5320 1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -2.7310 1.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -3.4600 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1100 0.3210 3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 1.3620 3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 2.5020 3.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 2.6160 5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 1.5780 5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 0.4310 4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 1.9340 6.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 3.0220 7.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 3.6210 6.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 1.2370 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 0.9840 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 1.1320 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -1.2350 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -1.1300 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -1.1560 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.5540 5.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -4.8740 6.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -5.5770 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -5.9980 5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 -4.0150 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -0.5960 4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -0.2340 6.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -1.1440 5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4120 -1.0560 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 1.2760 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 3.3070 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -0.3760 5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 2.6470 7.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 3.7370 7.7890 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 45 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 36 37 2 0 0 0 0 36 41 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 38 59 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 M END