IFLAB-ZINC05144829 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.5970 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 -1.9510 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.8750 -2.5520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -1.7760 -3.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -1.1920 -2.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 0.5850 -3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 0.8760 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 2.0170 -5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 2.8800 -5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 2.5810 -4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 1.4330 -3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 4.1050 -5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 4.3630 -6.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 4.9360 -5.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 6.0850 -6.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 6.9940 -6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 8.0980 -7.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 8.0110 -8.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 6.5650 -7.6580 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 9.0190 -9.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 9.2320 -7.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 6.8640 -5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 6.7600 -4.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -0.5200 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 0.2030 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -2.0280 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -2.7510 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -2.0410 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 0.2080 -4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 2.2430 -5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 3.2440 -3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 1.1980 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 4.7300 -5.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 9.7850 -8.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 8.5190 -9.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 9.4820 -9.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 10.0280 -6.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 9.6160 -8.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 8.8720 -7.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 3 0 0 0 0 M END