IBS-ZINC00517569 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 0.7050 1.5100 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 0.0030 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -0.6020 -2.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6720 -1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.0640 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -2.7960 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -4.1520 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -4.8490 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -4.0890 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.6900 -2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -4.7420 -3.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -6.0580 -3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -6.7880 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -6.1780 -1.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -8.2650 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -8.9440 -1.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -8.8380 -3.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -9.8040 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -8.0980 -4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -8.8990 -6.4130 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -6.7570 -4.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -6.2710 -5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 1.8600 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 1.8790 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 1.8810 -2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -0.1900 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -2.2700 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -4.6940 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.1080 -3.3620 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 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 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 M END