IBS-ZINC01738088 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.2140 1.0930 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -0.2300 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -0.7990 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -0.0480 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 1.2830 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 1.8500 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6990 0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5570 -1.6800 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -0.8240 1.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4280 -2.2490 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -2.5080 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -3.7340 3.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -4.0230 5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -3.0820 6.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -1.8610 5.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -1.5780 4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -3.3760 7.4990 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3750 -4.4360 7.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -2.5480 8.3040 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5230 -3.2070 1.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -0.3050 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -0.3220 1.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8350 0.2670 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 0.8160 -0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 0.0120 -0.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 0.3430 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 1.8120 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 2.1070 -3.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 3.5360 -4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 4.3540 -3.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 1.5390 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -0.8170 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -1.8350 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 1.9000 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 2.8870 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 -4.4690 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -4.9790 5.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -1.1260 6.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 -0.6330 4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -0.1630 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 0.1120 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -0.3160 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 2.0700 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 2.4540 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 1.9190 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 1.4240 -4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 3.7180 -5.4080 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 20 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 47 -1 M END