CHEMDIV-ZINC03142501 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 -0.6870 0.7710 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -0.6970 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -2.3540 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -2.5580 2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -0.5950 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -0.3860 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -2.2710 3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -2.1470 3.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 -3.2310 3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1510 -3.1360 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -1.9360 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2740 -1.5890 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 -0.2760 3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0840 0.5180 4.1520 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 -0.8580 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 -0.9520 4.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 0.1160 4.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7340 0.3590 3.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9990 1.6710 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2010 2.5380 4.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4750 1.9740 3.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3890 -2.4360 2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5540 -2.0460 2.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9910 -3.6620 2.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0230 -4.5450 1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6060 -5.3230 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 1.3520 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 0.8800 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 1.2110 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -1.2540 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -1.1280 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -2.9420 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -2.6330 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -2.0100 3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -3.6230 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -0.3270 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 0.0070 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 0.6810 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -0.9310 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -3.2870 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -1.5840 4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -4.1820 3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 -4.0180 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 0.8290 4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5190 -0.2350 3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8020 1.9110 2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6680 2.9840 4.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0410 1.2610 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5570 -5.2370 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7990 -3.9970 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3530 -6.0420 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 -4.6520 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8170 -5.8640 3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.8920 1.1420 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0400 -0.3370 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -2.0520 2.6890 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1900 -2.6190 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 54 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 3 54 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 56 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 56 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 7 56 1 0 0 0 0 8 9 1 0 0 0 0 8 16 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 54 1 M CHG 1 56 1 M END