NCID-ZINC03946007 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 2.0590 1.1910 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -0.1760 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.5850 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 0.3610 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 1.7240 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 2.1690 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 3.5670 0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 4.1710 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 3.6120 0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 5.9490 0.3570 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 6.3220 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 7.8130 0.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2560 8.2010 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 7.9380 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 8.0660 -0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7620 7.8010 1.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2120 7.7560 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 7.4240 3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 7.5150 4.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 8.6400 -0.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 9.4960 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 9.5960 0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 10.3200 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 11.5550 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 12.4800 -2.7160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4840 11.9540 -3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 13.6950 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 14.7580 -2.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 4.3850 0.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.2610 0.0420 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 1.4510 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -0.9090 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 0.0530 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 2.4350 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 5.7560 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 5.9550 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 7.7120 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6220 7.0040 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6170 8.7350 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 8.5810 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 10.6160 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 9.6820 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 11.2270 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 12.1080 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 5.2710 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7990 7.0940 3.4330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2500 13.4920 -2.0310 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1850 13.0780 -3.0770 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5150 12.8740 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 13.0160 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 14.1100 -3.0720 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 48 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 29 45 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 M CHG 1 46 -1 M CHG 1 47 -1 M CHG 1 48 1 M END