IBS-ZINC06665582 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -4.7670 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -4.9620 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -4.6940 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -4.2270 -3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -4.0280 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -4.3080 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7360 -3.5740 -2.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 -3.4840 -3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -3.8730 -4.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 -3.9100 -5.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -5.2810 -6.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9450 -5.4750 -5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -5.3640 -7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3980 -3.0160 -3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3660 -1.5640 -4.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0010 -0.9050 -5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 0.4120 -4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 0.5540 -3.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6960 -0.6260 -3.1290 C 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 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -5.3250 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -4.8460 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 -4.1620 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 -3.1360 -5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -3.7360 -5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 -6.0610 -5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5490 -4.6950 -6.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2860 -6.4510 -6.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0440 -5.4160 -4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -5.2260 -7.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 -6.3400 -7.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -4.5840 -8.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 -3.5050 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1740 -3.2680 -3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 -1.3560 -6.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 1.2130 -5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0320 -0.8190 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 37 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 30 55 1 0 0 0 0 M END