IBS-ZINC02094600 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 0.0100 1.4810 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.0260 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.7230 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.1060 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.7910 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.0930 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.7110 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5520 -0.0270 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -4.9420 -1.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.9550 1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -5.0580 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -4.7650 -1.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0180 -3.8830 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -5.9590 -2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -6.1410 -2.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -6.9510 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -7.1180 -2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -6.4740 -3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -5.6640 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -5.5010 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -4.5070 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -4.5630 0.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 -4.2160 -1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 -4.1040 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8460 -5.2140 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1300 -5.1000 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6090 -3.8820 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8020 -2.7550 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4970 -2.8640 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -1.6680 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -0.4990 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4770 -0.4660 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 0.5920 0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2520 -1.5570 0.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 0.7900 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 0.5140 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -0.4400 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -1.8060 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0150 -6.3180 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.8530 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8440 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 1.8350 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.1880 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.6500 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.6290 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.1660 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -5.5480 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -6.8590 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -5.7780 -2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -7.4540 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -7.7500 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -6.6040 -4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -5.1610 -5.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -4.8710 -4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4870 -6.1730 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6120 -3.8080 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 1.3940 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 1.3370 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 1.4480 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 0.0520 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -0.0560 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -0.5320 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -2.2570 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -2.4480 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8740 -6.8150 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0570 -6.0160 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7530 -7.0030 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 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 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 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 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 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 34 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 38 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 36 37 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 37 38 1 0 0 0 0 37 61 1 0 0 0 0 37 62 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 M END