IBS-ZINC04729131 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.1290 1.1560 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 0.8000 2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 3.0220 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.4810 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 5.4240 3.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7180 4.4010 3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 4.8450 4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 4.9450 5.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 5.9960 5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 5.5920 4.8590 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4460 4.6520 5.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 6.6940 4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 6.7790 3.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8200 7.4750 2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 5.4020 2.7380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4690 5.4600 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 5.9530 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 7.3590 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 7.2950 3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 4.4400 3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 3.6980 4.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 6.7200 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 7.7190 2.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 0.0870 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 1.3580 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 1.7040 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 0.9340 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -0.2550 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 1.1380 3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 3.5730 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 3.2130 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 3.1740 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 3.0280 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 4.3130 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 3.4320 3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 5.8180 4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 4.1140 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 5.2400 6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 3.9800 6.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 6.9580 5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 6.0840 6.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 7.6500 5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 6.4810 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 4.4640 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 6.1410 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 5.2790 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 5.9830 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 7.7310 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 8.0250 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 8.2910 3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 6.6230 4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 1.5840 1.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 4.9440 2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 52 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 52 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 22 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 3 0 0 0 0 22 23 3 0 0 0 0 M END