CHEMBRIDGE-ZINC00752174 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 49 0 0 0 0 0 0 0 0999 V2000 -0.1300 1.3250 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.2000 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -0.5780 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -0.4030 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -0.5780 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -0.3860 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 -0.0820 1.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -0.0780 2.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 0.2170 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 1.2640 3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 1.5520 5.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 0.7980 6.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -0.2460 5.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -0.5350 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 1.1090 7.5130 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2230 2.0290 8.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 0.4460 8.1950 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9820 -0.8750 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.7130 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -1.1160 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -1.1860 -2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -1.6190 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -1.9740 -4.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -1.9130 -4.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -1.4790 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -1.3110 -2.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -1.4770 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.7940 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 1.7560 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 1.6020 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 1.7010 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 0.0570 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -1.6190 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -0.4720 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 1.8530 3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 2.3670 5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -0.8340 6.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -1.3480 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -0.9110 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -1.6860 -4.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -2.3080 -5.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -2.1910 -5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -0.4050 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -1.8800 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -0.5200 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END