IBS-ZINC04458318 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.4980 1.6990 1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 0.3760 1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.1900 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 0.5720 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 1.9020 1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 2.4610 2.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 0.0030 1.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 0.9820 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 0.3780 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -0.9090 1.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -1.8910 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -1.1980 1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9970 -1.1870 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -0.3960 2.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1190 -0.7860 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1120 -0.0850 3.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 -2.1360 3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9730 -2.8050 4.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3300 -2.2580 4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0140 -2.3370 5.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2860 -1.8220 5.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8920 -1.2240 4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2170 -1.1420 3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9460 -1.6590 3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1460 -0.7170 4.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4010 -2.6790 3.0280 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 2.1400 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -0.2170 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -1.2240 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 2.4970 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 3.4940 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 1.8820 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 1.2360 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 0.2200 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 1.0540 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -2.2680 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 -2.7170 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -0.9140 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -1.8800 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7230 -3.7400 4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5450 -2.8010 6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8150 -1.8820 6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6920 -0.6770 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4250 -1.6000 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8460 -1.3510 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 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 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END