NCID-ZINC05850746 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 0.6790 2.0250 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 0.9920 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 0.0640 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 0.1610 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 1.1940 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 2.1460 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 3.1860 -0.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 4.1940 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 4.3600 1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 5.3320 -0.3320 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 6.5450 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 7.8270 0.6120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3550 8.2120 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 7.6210 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 7.6590 1.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 7.4170 -0.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 7.2670 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5530 7.2000 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 7.1530 -3.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 8.8700 1.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 9.5500 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 9.3790 0.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 10.5000 2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 11.1940 3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 11.9980 4.3150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6460 12.6600 4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 12.8330 4.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 12.5370 5.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 3.1430 -1.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -1.2030 0.5750 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 2.7210 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 0.9260 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.5580 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 1.2450 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 6.7930 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 6.0670 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2140 7.3580 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7230 8.1150 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5370 6.3470 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 9.0670 2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 9.9180 3.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 11.2450 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 11.8510 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 10.4560 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 3.8760 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7850 7.2030 -2.6800 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2220 13.6180 3.4450 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7380 11.0650 5.5120 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5170 11.1620 6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 10.0900 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 11.4710 5.9800 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