PUBCHEM-ZINC03083138 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.5340 1.6200 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.2450 1.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -0.6570 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -0.2850 0.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -2.0360 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -2.7470 2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -4.0800 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -4.4420 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -3.1160 -0.1680 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -5.2190 3.2320 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5820 4.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -6.4480 2.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -5.3120 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -6.2670 4.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -7.5770 4.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -8.2540 5.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 -7.4940 6.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -5.8250 5.8800 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -2.1830 3.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -0.8680 3.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.3050 4.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 1.0750 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 2.1700 4.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -1.2430 5.1860 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -2.2850 5.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -1.4820 4.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -0.2030 6.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -0.1800 7.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 0.6360 8.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 1.4300 8.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 1.4060 7.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 0.5860 6.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3430 2.4550 9.5770 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 1.7650 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 2.2370 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 1.9070 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -5.4430 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -5.6650 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -4.3230 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -8.0720 3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -9.3170 5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 -7.8490 7.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -2.7000 3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -0.7990 7.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 0.6540 9.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 2.0250 6.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 0.5640 5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 3 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 46 1 0 0 0 0 32 47 1 0 0 0 0 M END