NCID-ZINC05208275 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 4.1860 1.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 5.9260 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 6.8260 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 8.2010 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 8.6030 0.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 7.7220 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 6.4140 0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 8.1810 -1.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 8.8420 3.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 7.8760 4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 6.6900 3.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 8.1830 6.1610 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 6.4830 6.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 6.4970 8.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 6.4880 8.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 6.5020 10.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 6.5240 11.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 6.5310 10.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 6.5140 8.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 6.5390 12.5320 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1810 6.5320 13.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 6.5580 13.1310 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0950 10.2900 3.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8030 10.8070 2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 10.7790 4.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0310 9.9660 4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 11.8850 5.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5630 12.8420 4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 11.9330 5.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2460 12.7030 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 10.6260 4.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 12.1940 6.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 12.3510 6.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 11.5370 6.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 11.3150 3.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.9460 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 9.1340 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 7.5490 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 5.9540 6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 5.9770 6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 6.4720 8.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 6.4960 10.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 6.5490 10.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 6.5160 8.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 11.3520 7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 13.1030 7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 12.5200 7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 12.1960 7.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 11.6370 3.2940 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 46 1 0 0 0 0 2 3 2 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 4 5 2 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 50 1 0 0 0 0 7 51 1 0 0 0 0 8 9 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 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 38 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 42 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 41 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 39 40 1 0 0 0 0 39 60 1 0 0 0 0 39 61 1 0 0 0 0 40 62 1 0 0 0 0 41 63 1 0 0 0 0 42 64 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M CHG 1 43 1 M CHG 1 45 -1 M END