CHEMBRIDGE-ZINC04915087 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.9480 0.5940 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 1.0990 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 2.9970 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 3.6800 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 3.7610 0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 3.7010 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 4.5950 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 4.5560 -2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 3.6370 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 2.7500 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 2.7910 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 1.8400 0.7380 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2240 1.5630 1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 1.3480 1.0910 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.3820 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 0.5520 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 0.9230 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 1.0870 2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 0.0980 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 1.7850 3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 2.9490 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 3.5400 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 4.6970 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 3.1270 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 5.3430 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 5.2550 -3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9430 3.6200 -3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 2.0410 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 1.5750 1.3000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4250 1.5870 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 29 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 29 1 M END