PUBCHEM-ZINC03873901 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0300 1.2260 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 0.0490 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -0.5720 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 0.0000 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 -0.7720 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 -1.9410 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -2.0350 -0.9240 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -3.3030 0.0550 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -4.3740 -0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 -2.6820 -0.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -3.8560 1.6280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -4.4570 2.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1280 -4.9910 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -5.3800 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -4.4360 4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -3.3710 4.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -3.3910 3.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -2.6380 2.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 -2.3730 5.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -1.1570 5.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 0.0230 4.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 1.1660 4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 1.0880 4.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6040 -0.0720 5.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 -1.1760 5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 -2.2970 6.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 2.4430 4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 3.5640 4.7080 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1180 3.5500 5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 4.4680 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 1.1570 1.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 1.7160 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.7460 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -0.3770 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 -0.5200 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -3.2570 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -6.0780 3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -5.9680 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -4.9180 5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 -4.0230 4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.0660 5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -2.8290 6.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 0.0510 4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7490 1.9370 4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6490 -0.0930 5.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 -2.1480 6.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 2.6330 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 2.4890 3.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 1.6640 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 3.3590 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 31 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 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 17 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 31 32 1 0 0 0 0 32 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 28 1 M END