IBS-ZINC01451078 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.4500 1.5910 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 0.1620 -0.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -0.4880 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 0.2360 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -0.4190 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -1.7980 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -2.5360 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -1.8720 -1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -4.0080 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -4.6460 -1.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -4.7210 -3.6220 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4010 -5.0780 -2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -6.5630 -3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -7.1990 -2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -7.1040 -3.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -6.0770 -4.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5110 -6.2210 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -6.1380 -5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -5.9100 -6.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -5.9660 -7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -6.2520 -8.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -6.4800 -7.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -6.4180 -6.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -6.7600 -8.5360 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -8.4710 -3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -9.3470 -3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 -10.7030 -3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -11.1390 -4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -10.2140 -4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -8.9270 -4.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -4.3100 -2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 1.9430 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 1.9360 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 1.9830 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 1.3160 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 0.1510 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -2.3060 -4.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -2.4360 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -5.6870 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -5.7880 -7.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -6.2970 -9.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -6.5920 -5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -8.9730 -3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -11.4060 -3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -12.1910 -4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -10.5480 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -4.1050 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 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 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 31 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 42 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 M END