PUBCHEM-ZINC01025844 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.0070 1.7140 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 0.4430 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -0.3180 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 0.1780 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 1.4500 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 2.2260 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 3.5760 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.9850 -0.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 4.3150 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 5.6300 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 6.0120 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 5.6950 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 6.2250 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 6.9350 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 6.9500 0.6530 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4970 7.8020 0.8010 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5070 7.2620 2.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 7.6570 -0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 9.4710 0.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 9.9710 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 11.2010 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 12.7150 4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1190 13.4300 5.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 13.5430 3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 12.2190 3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -1.8850 2.2870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 2.3030 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 0.0570 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -0.4240 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 1.8010 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 3.9620 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 5.6130 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 6.3270 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 5.1040 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 6.0910 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 9.9590 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 10.2250 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 9.2090 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6360 10.9560 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 12.0410 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 13.3790 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9310 12.2090 5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 12.8250 5.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 14.4040 5.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 13.7370 4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 14.3650 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 11.4860 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 12.3480 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7390 11.6680 3.6290 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5270 10.8600 4.2330 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 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 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END