CHEMBRIDGE-ZINC01135853 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.1260 1.1700 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.2090 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.8160 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -0.0450 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 1.3340 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 1.9420 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -0.4230 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -1.4440 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -1.1830 -3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 0.0990 -3.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 1.1210 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 0.8610 -1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -0.1650 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 0.6760 1.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -0.6160 1.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 -0.0890 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 -0.7510 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 -1.5780 1.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 -0.4220 3.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 -1.1000 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 -0.6060 4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9090 -1.2420 5.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 -0.7880 6.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5330 0.3000 6.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5700 0.9360 5.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7800 0.4800 4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3810 0.7860 7.7000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.3480 0.2270 8.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1130 1.7460 7.5330 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0960 1.6440 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.8120 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -1.8940 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 1.9370 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.0190 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -1.7840 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -2.4460 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -1.9810 -4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 0.3030 -4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 2.1230 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 1.6600 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -1.2880 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 0.9880 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 -0.2950 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 -2.1750 3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5720 -0.8920 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2600 -2.0920 5.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6730 -1.2850 7.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2190 1.7860 5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8120 0.9740 3.3630 H 0 0 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 14 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END