IBS-ZINC05272485 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0950 1.5020 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.0280 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -0.5020 -1.3560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8350 -0.0390 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -2.0010 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -2.6850 -2.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.5820 -0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -3.9710 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -4.5930 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -5.9600 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -6.7300 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -6.1000 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -4.7320 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -8.1940 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -8.7380 0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -9.0200 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.1220 -2.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -0.5880 -2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -0.2970 -4.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 0.5070 -5.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 0.8210 -6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 1.6410 -7.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 2.1620 -6.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 1.8670 -5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 1.0390 -4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 0.6940 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 1.1220 -3.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 1.8940 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.8610 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 1.8400 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -0.3870 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -0.4200 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -2.0340 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -3.9990 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -6.4410 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -6.6890 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -4.2450 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -9.2740 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -9.9350 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -8.4490 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -1.2330 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 0.4210 -6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 1.8830 -8.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 2.8040 -7.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 2.2750 -5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END