ANALYTICONDISCOVERY-ZINC05438768 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 78 0 0 1 0 0 0 0 0999 V2000 -0.2590 -0.7670 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -2.1070 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -2.4570 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -1.4760 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -0.1300 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 0.2220 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -1.8410 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -1.2490 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -1.5870 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 -2.5330 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 -3.1210 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 -2.7830 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 -2.8740 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5310 -4.1410 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8940 -4.3040 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7730 -3.3130 0.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2670 -2.1100 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9510 -1.8600 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 -1.0470 -0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5450 -1.1490 -0.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8510 -1.5760 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1470 -1.9340 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4890 -1.4520 -1.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5780 -0.1400 -0.8340 C 0 0 3 0 0 0 0 0 0 0 0 0 14.8740 0.5710 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2200 0.2080 -0.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6520 0.8630 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4190 0.8810 1.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8330 0.9650 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5020 -0.0920 0.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 15.4890 -1.0610 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8760 0.2510 0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 17.9290 -0.1390 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8070 -0.8410 1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 19.2840 0.4030 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9910 -0.3630 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3360 -1.8110 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5610 -1.6970 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2760 -0.4160 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4090 0.2160 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2030 -0.3590 -2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7660 1.0390 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6820 1.4290 -1.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -0.4940 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -2.8810 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -3.5100 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 0.6590 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 1.2690 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -0.5180 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9240 -1.1020 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -3.8380 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -3.2540 1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 -4.9730 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3340 -5.2640 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6290 -0.1800 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1780 -3.0100 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6010 -1.7700 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1550 1.9780 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0320 0.8180 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0940 0.8280 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1690 1.4640 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9080 0.4070 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5120 -2.3330 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6040 -2.4030 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2590 -1.6270 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 22.2090 -2.5740 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3770 0.2610 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2850 -0.6210 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8100 -0.0760 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4350 1.3100 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8000 -0.8080 -2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3120 -0.9920 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5230 1.6200 -3.3110 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 44 1 0 0 0 0 2 3 2 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 36 40 1 0 0 0 0 36 41 1 0 0 0 0 37 38 1 0 0 0 0 37 63 1 0 0 0 0 37 64 1 0 0 0 0 38 39 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 39 40 1 0 0 0 0 39 67 1 0 0 0 0 39 68 1 0 0 0 0 40 69 1 0 0 0 0 40 70 1 0 0 0 0 41 42 1 0 0 0 0 41 71 1 0 0 0 0 41 72 1 0 0 0 0 42 43 2 0 0 0 0 42 73 1 0 0 0 0 M CHG 1 73 -1 M END