IBS-ZINC04085349 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0630 1.3350 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.1940 -0.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4960 -0.5470 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.7350 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -1.4370 0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.6590 1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -0.7510 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.4500 0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -1.2300 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -1.2400 2.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -1.6490 3.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -2.0320 4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -2.4440 5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 -2.4820 5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 -2.0980 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 -1.6870 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5320 -2.2180 4.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9360 -2.6670 5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2170 -2.8920 5.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3110 -2.7580 4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6170 -3.1110 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6390 -2.9840 4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3790 -2.5070 2.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0860 -2.1530 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0500 -2.2820 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8380 -1.6850 1.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9540 -1.5830 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7330 -2.8670 6.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -3.2620 7.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 1.7260 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 1.6810 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.6880 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.9000 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -0.5600 3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -2.2370 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -2.0020 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 -2.7400 6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 -1.3920 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4340 -3.1700 6.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8250 -3.4830 5.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6470 -3.2560 4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1840 -2.4100 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0430 -2.0120 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3990 -2.5690 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6180 -1.1980 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6950 -0.9060 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -0.4370 -1.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -0.8070 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 47 48 1 0 0 0 0 M END