IBS-ZINC02121154 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 71 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0240 -0.7640 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.1080 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.8560 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.5160 5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -1.6950 5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -2.7140 4.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.2640 3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.9090 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1720 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7960 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.1060 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7120 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6950 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0430 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 0.2000 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -0.2430 -2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 0.8340 -4.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 0.9860 -4.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5440 0.1060 -4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 1.1400 -6.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -0.1320 -6.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -1.1460 -7.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -2.1300 -7.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -2.9620 -8.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.7650 -7.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -0.5000 -7.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 0.1240 -6.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -0.5000 -7.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -1.7490 -7.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -2.3800 -7.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 2.2100 -4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 2.8850 -3.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -4.4150 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.8420 5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 1.1580 6.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 2.4220 7.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 3.3770 6.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 3.0680 5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 1.8040 5.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 4.9660 7.4980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 0.9710 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -1.8030 6.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -0.5210 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.0270 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 1.1880 -4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 1.9670 -6.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 1.3420 -6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.1790 -7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 1.0960 -6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -0.0170 -6.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -2.2300 -7.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -3.3530 -8.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -4.7920 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -4.7370 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -4.8060 3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 0.4140 7.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 2.6690 8.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 3.8160 5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 1.5630 4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 2.5500 -4.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 3.3430 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 15 2 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 2 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 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 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 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 50 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 65 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 36 37 1 0 0 0 0 36 41 2 0 0 0 0 37 38 2 0 0 0 0 37 61 1 0 0 0 0 38 39 1 0 0 0 0 38 62 1 0 0 0 0 39 40 2 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 40 63 1 0 0 0 0 41 64 1 0 0 0 0 65 66 1 0 0 0 0 M END