IBS-ZINC02268229 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 0.0340 -2.7280 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.0140 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -2.7630 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.1720 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.7590 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 0.0250 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.6620 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 0.2440 -2.6920 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.5340 -3.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 1.5830 -2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 0.2790 -3.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -0.9190 -3.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -1.1130 -4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -0.2490 -5.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -2.3790 -4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 -2.6010 -6.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -3.7960 -6.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -4.7190 -5.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -4.5510 -4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -3.3830 -3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 1.3180 0.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 1.5180 1.8760 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.0370 2.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -2.7540 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -2.1990 -3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -3.7460 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -3.8400 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.7760 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 1.1280 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -1.6080 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -1.8490 -6.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -3.9770 -7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -5.3340 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -3.2500 -2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 23 2 0 0 0 0 6 7 1 0 0 0 0 6 21 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 M END