CHEMBRIDGE-ZINC05005939 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.2150 1.5740 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 0.0510 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -0.4940 0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -1.8430 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -2.4360 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -3.8040 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -4.5980 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -3.9960 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -2.6260 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -6.0580 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -6.6040 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -5.9130 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -4.7090 -1.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -6.6910 -1.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 -8.0380 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 -8.9430 -1.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -8.3150 -0.5010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.9890 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 1.9770 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.8420 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.2170 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -0.3520 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -1.8220 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -4.2640 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -4.6040 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -2.1600 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -6.6970 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0350 -6.3150 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -9.8750 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 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 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 29 1 0 0 0 0 M END