IBS-ZINC05350671 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.4540 1.1500 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.1590 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.7150 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -0.0170 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -0.5920 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -0.1440 4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -1.1250 4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -2.1890 3.9990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -3.0160 4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -1.8800 2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -2.5720 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -1.9960 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -2.6780 -0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -3.9820 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -1.0650 6.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 0.0120 6.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -2.2030 6.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -2.1590 8.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -2.9150 9.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -4.2220 8.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -4.2660 7.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -3.5100 6.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -5.3600 9.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -6.4380 8.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -5.2980 10.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -6.3660 11.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -5.8480 12.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -4.5040 12.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -4.1770 11.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 1.8440 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 1.4740 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 1.1290 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 0.9710 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 0.8070 4.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -3.5600 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -4.4150 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -3.9100 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -4.6170 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 -2.6340 8.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 -1.1230 8.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -3.0590 10.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -2.3440 9.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -5.3020 6.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -3.7910 7.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -3.3650 5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -4.0820 6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -7.4070 11.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 -6.4170 13.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -3.8090 13.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 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 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 36 1 0 0 0 0 14 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 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 M END