CHEMBRIDGE-ZINC04990285 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.9910 -0.1430 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 0.3200 0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -0.5380 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 0.0470 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -0.6520 3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -1.9630 2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -2.5520 1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -1.8490 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -3.9300 1.4590 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9990 -4.5440 2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -4.3920 0.3950 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7430 0.0030 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 1.3140 6.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 1.7650 7.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.3650 7.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -0.8080 6.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 1.0260 9.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -0.0880 10.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.6210 11.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -1.6710 12.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -2.1990 11.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -1.6740 10.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -0.6220 10.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -0.9990 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 0.6670 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -0.3580 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 1.0800 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -2.5210 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -0.6450 4.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 0.9220 4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 2.1810 6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 0.7560 7.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 2.3360 8.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 2.3730 7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 0.1770 6.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -1.2410 7.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -1.4040 6.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -1.3890 5.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 1.5110 8.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 1.7880 9.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -0.2190 11.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -2.0750 12.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -3.0150 12.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -2.0820 10.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -0.2270 9.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -2.4120 -0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 0.3980 5.5680 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9990 0.9350 5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 0.5710 8.2860 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3120 0.0380 8.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -3.3110 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 47 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 49 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 46 51 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M CHG 1 47 1 M CHG 1 49 1 M END