CHEMBRIDGE-ZINC04731653 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.0340 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -0.0520 2.7300 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -0.5770 4.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -1.1500 3.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -1.4610 4.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -1.1880 6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -0.4120 5.7640 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -1.4540 7.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 -2.0500 7.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 -2.3540 6.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -2.3380 8.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7900 -3.0130 8.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 -3.3010 10.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -4.5070 10.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 -4.7710 11.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4350 -3.8310 12.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -2.6260 11.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 -2.3630 10.6380 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -2.3100 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -2.3950 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -2.4820 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -1.2110 8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 -1.4050 9.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -3.0000 9.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -3.9460 8.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 -2.3510 8.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -5.2420 10.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -5.7130 12.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -4.0370 13.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 -1.8910 12.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -1.4230 10.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 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 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END