NIH-ZINC00295802 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 0.1560 1.3710 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.0750 -0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -0.8300 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.4450 2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -1.4390 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.7760 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -3.1510 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -2.1710 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -2.1890 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.8850 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -0.4220 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -0.6150 -3.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 0.3290 -2.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 0.8070 -4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -3.6210 -1.6780 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -3.1840 -2.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -4.6050 -0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -3.8720 -1.6160 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.4890 -3.0920 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 1.6460 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.7510 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 1.7880 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 0.5960 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -1.1610 4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -3.5390 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -4.2020 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -0.0280 -5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 1.4990 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 1.3470 -4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 18 -1 M END