IBS-ZINC05242111 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -1.8960 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -2.3590 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -1.4550 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -0.1190 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.3140 0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 0.5480 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -0.4250 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -1.6040 0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 2.0090 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 2.6760 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 4.0380 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4750 4.7420 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 4.0870 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 2.7240 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -3.7070 -0.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -4.6620 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -6.0600 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -6.6260 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -7.9130 -1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -8.5840 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -7.9530 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -6.7290 0.6770 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -2.5860 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9780 -0.2350 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 2.1270 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8780 4.5550 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6180 5.8080 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 4.6420 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 2.2130 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -4.0230 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -4.4340 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -4.5900 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -6.0740 -2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -8.3810 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -9.5870 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -8.4680 1.5600 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 11 35 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 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 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 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 M END