IBS-ZINC04870528 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.2640 0.1670 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 0.0420 2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 2.1870 1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 2.6830 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 4.2030 3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 4.6700 4.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 5.3070 5.2980 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5700 6.1800 5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 5.7810 5.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 5.2020 5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 4.5540 3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 4.0380 2.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7680 5.1940 5.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 6.5970 6.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 7.0910 7.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 7.0480 7.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 6.4290 8.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 6.8780 9.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 7.9460 8.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7950 8.5720 7.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 8.1250 6.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4540 8.3830 9.1420 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 4.3580 6.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 3.2060 6.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 2.3560 7.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 2.6410 7.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 3.7800 7.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 4.6250 6.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 4.1710 7.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 3.4980 8.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.9240 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 0.4900 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 0.5790 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.4100 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -1.0430 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 0.3000 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 2.5300 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 2.5260 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 2.2000 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 2.4000 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 4.7130 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 4.5010 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 7.6640 8.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 5.5950 9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 6.4040 10.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3330 9.4040 7.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 8.6220 6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 2.9560 6.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 1.4690 7.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 1.9550 8.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 5.5110 6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 3.9950 8.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 3.5630 9.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 2.4560 8.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 0.6710 1.8250 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6470 0.3590 1.9650 H 0 0 0 0 0 0 0 0 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 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 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 55 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 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END