IBS-ZINC00054098 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 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 0.7180 -0.4980 -1.2570 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 -0.0300 -0.1300 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -0.9880 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -0.6430 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 0.5710 4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.4320 4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 1.0750 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.9470 5.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 2.1350 6.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 2.0380 7.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 0.8380 7.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 0.4960 8.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 0.2320 6.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 3.0300 8.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 4.0640 8.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 2.7930 9.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 3.7380 10.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 3.5100 11.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 4.5040 12.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4650 4.2700 13.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6510 5.2350 14.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 6.3880 14.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 6.5820 13.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 5.6920 12.7720 C 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 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -1.9290 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -1.3140 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 2.3750 4.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 1.7400 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 2.9490 6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 1.9690 9.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8320 2.5920 11.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 3.3610 13.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 5.0890 15.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 7.1420 15.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 5.8850 12.0180 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 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 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 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 M END