IBS-ZINC02112846 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 73 0 0 1 0 0 0 0 0999 V2000 0.4530 1.6840 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 0.1890 -0.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6860 -0.0720 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.1340 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 0.6140 2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 0.2960 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -0.4520 3.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.6160 -1.4160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9400 -0.4940 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.1860 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -1.4680 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -2.6070 -2.7190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5910 -2.7170 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -2.1210 -1.2590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9430 -2.1670 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -3.5700 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -3.9230 -2.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1580 -3.1740 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -3.9270 -2.9300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4060 -4.7190 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -4.2370 -4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -5.5210 -4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -5.9640 -3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -5.2860 -2.5540 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7450 -5.1510 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -6.5290 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -7.0820 -4.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3460 -6.3750 -4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -7.2700 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7100 -8.3500 -4.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0380 -8.6710 -5.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -7.9180 -6.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 -9.9700 -5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -6.1670 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.8720 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 1.9460 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 1.9140 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 2.2580 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.2060 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 0.1770 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 1.6870 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 0.3030 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 0.2580 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 0.5260 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -1.6510 -3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -1.3780 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -1.8890 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -1.4600 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -4.2860 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -3.5980 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -3.4270 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -4.3360 -4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -6.1030 -5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -4.7390 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -4.4860 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -7.2060 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -6.4420 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -7.5840 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -8.0380 -3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 -9.9920 -5.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9270 -10.0560 -6.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -10.8030 -5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -5.7080 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -7.1520 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -6.2670 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -2.6460 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -3.9440 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.5610 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 0.8430 4.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 0.6090 5.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 69 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 69 70 1 0 0 0 0 M END