IBS-ZINC04043631 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 0.0550 1.5450 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 0.0380 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.6500 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.0320 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.7270 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.0400 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.6570 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -4.2340 -0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1070 -4.7470 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -6.2760 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -6.6920 -0.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -6.2800 -1.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7820 -6.6830 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -4.7510 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -6.8030 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -8.3310 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -6.2370 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.7400 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -4.1290 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -4.7030 0.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -5.9690 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 -5.6900 -1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -5.5070 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3730 -5.2510 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 -5.1770 -3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -5.3610 -3.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -5.6220 -2.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -4.9250 -4.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 -4.8640 -5.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -4.0680 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 -4.4890 1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -2.8330 1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 1.9110 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 1.9040 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 1.9100 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.1060 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.5690 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.5830 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.1200 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -4.4300 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -4.3450 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -6.6790 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -6.6460 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -4.3500 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -4.4370 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -6.4890 -3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -8.6440 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -8.7020 -3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -8.7340 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -6.6090 -4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -6.5500 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -5.1480 -3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -4.4490 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -5.8260 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -4.3460 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -3.0500 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -6.5000 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -6.5810 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9770 -5.5640 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4340 -5.1080 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -5.3040 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -5.7700 -2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5240 -5.8170 -6.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2590 -4.0700 -5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7580 -4.6570 -6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -2.6630 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -2.9700 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -1.9740 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 18 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 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 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 59 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 M END