CHEMBRIDGE-ZINC04729758 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.7910 1.8380 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 0.3590 0.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1180 0.1540 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -0.5350 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -2.0310 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -2.8280 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -3.1130 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -3.8350 -1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -4.2740 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -3.9910 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -3.2690 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 0.4060 2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 0.4610 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -0.6410 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3230 -0.5600 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -0.5890 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -1.1420 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -1.0610 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -0.4180 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 0.1440 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 0.0620 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 0.8350 -2.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2190 0.9480 -1.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 1.2710 -2.9670 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1620 -1.8960 0.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 2.4940 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 2.0870 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 2.0830 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -0.3630 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -0.2190 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -2.2010 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -2.4160 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -2.7760 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -4.0560 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9630 -4.8360 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 -4.3330 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -3.0560 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 0.0250 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 1.4930 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -0.0670 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 0.5370 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 1.4440 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -1.6420 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 -1.4980 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 -0.3650 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 0.5050 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -2.5960 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 0.0290 1.1730 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7160 -1.0050 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 48 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 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 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 48 1 M END