IBS-ZINC05219761 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.7490 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -1.2070 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -1.4200 3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -1.1730 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -0.7200 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -1.8830 4.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 -2.1220 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -3.4530 5.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -3.3620 6.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -2.8290 6.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -2.1350 5.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.7870 6.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -2.2150 7.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -2.8960 7.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -3.4650 9.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -4.0470 9.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -3.3300 9.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -2.6920 9.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -2.6150 10.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.1070 8.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -1.4150 7.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -3.9030 11.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -2.8790 12.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -1.7780 11.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -3.1860 13.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.5830 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -1.3980 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 -1.3380 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -0.5310 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -2.1730 3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -1.3140 5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -4.2510 4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 -3.6700 5.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 -4.3550 7.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 -2.6990 7.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -2.1260 7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.9780 8.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -0.6270 7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -4.1950 11.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -4.7790 11.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -4.0660 13.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.5260 14.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END