IFLAB-ZINC04554382 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 -1.2340 -0.1850 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -0.8630 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.4270 3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.4840 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 0.8600 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 2.2580 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 2.9620 0.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 2.5980 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 1.6440 1.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 3.5030 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 4.4740 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 3.1690 0.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6550 3.8680 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 5.4040 0.3640 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3980 5.5260 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1160 5.9910 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0110 5.5950 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2860 6.1630 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6450 7.1240 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7910 7.5180 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5300 6.9750 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3320 8.4770 1.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6270 8.6440 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8330 7.7830 0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 6.3520 -1.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7050 6.9230 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 8.1550 -2.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 7.9850 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2050 7.4610 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 0.4990 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -0.9380 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 0.3820 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -1.5530 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -1.4200 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 0.2100 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -1.4170 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 0.5140 4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -1.1280 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.8820 4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 0.9520 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.1950 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 2.8810 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 2.2010 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 3.7650 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 2.3550 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5420 3.3780 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6370 3.6550 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7290 4.8410 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9710 5.8610 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8900 7.3160 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7300 9.6860 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4000 8.4290 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 5.3860 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 7.0560 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 7.1290 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 6.2140 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 8.9610 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 7.3120 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 8.1560 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 7.2700 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 0.1760 1.7070 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3710 0.8930 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6570 6.1490 -0.4600 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8110 5.5290 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 61 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 63 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 63 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 29 63 1 0 0 0 0 61 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 61 1 M CHG 1 63 1 M END