IBS-ZINC05455813 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 0.3240 1.4850 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.0120 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -0.8440 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.1380 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -2.0970 -0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.7630 -1.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -3.2000 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -4.1950 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -5.2810 -1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -5.3780 -3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.3880 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -3.2970 -2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -3.3700 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -0.4090 2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 0.8480 2.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 1.2610 4.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 2.5960 4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.1120 5.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 2.6120 6.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 4.4830 5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 5.5220 6.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 6.8170 5.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 7.0870 4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 6.0680 3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 4.7500 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 3.5610 3.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 1.7280 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 1.9120 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 1.8980 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -4.1210 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -6.0560 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -6.2280 -3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -4.4660 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -2.5220 -2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -3.6000 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -4.2100 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -3.1930 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -1.1380 3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 0.6070 4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 5.3180 7.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 7.6260 6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 8.1050 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 6.2850 2.6310 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 6 2 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 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 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 1 0 0 0 0 18 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 M END