IBS-ZINC04981533 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -0.2570 -1.9480 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -1.9980 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.5740 4.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.7680 4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -0.2360 1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 1.2770 2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 1.7270 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 3.1750 1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 3.8420 2.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2970 3.5310 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 5.3270 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 5.4670 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 4.1060 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 3.8730 -0.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 6.5180 0.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 6.3410 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3690 6.0560 4.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 7.7350 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 8.7390 3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 10.0420 2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 10.3620 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 9.3720 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 8.0610 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 9.6930 -0.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 11.0660 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 3.5060 3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 3.2560 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 2.9510 6.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 2.9060 6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 3.1490 5.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 3.4480 4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -1.5690 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -2.9500 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -1.2880 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.3650 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -2.6660 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 0.4000 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -1.3560 4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -1.7430 4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -0.7130 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 0.0140 4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -0.4940 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -0.7480 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 1.7860 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 1.5250 3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 1.2180 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 1.4790 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 6.8300 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 8.4930 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 10.8160 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 11.3840 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 7.2920 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 11.1850 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 11.3880 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 11.6750 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 3.2980 4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 2.7510 6.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 2.6680 7.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 3.6450 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -0.6490 2.5580 N 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 35 1 0 0 0 0 2 36 1 0 0 0 0 2 60 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 60 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 48 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 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 53 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 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 M END