IBS-ZINC04870810 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -2.0040 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -2.6300 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4790 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1420 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.5410 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -2.0830 4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -3.0250 5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -3.9840 5.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -4.7770 6.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -3.6760 4.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -2.6000 6.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -3.2150 7.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -1.4360 6.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 -1.0190 5.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3490 -0.9520 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 0.3100 5.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 1.2360 4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 2.4550 4.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 2.7500 5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 1.8230 6.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 0.6020 6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 4.2820 6.3340 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.7620 -0.7420 6.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5010 -1.2500 7.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 -0.5620 8.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 0.6310 7.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2440 1.1390 6.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 0.4530 6.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -2.5930 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -3.7090 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.1120 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.2200 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 1.0060 3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 3.1780 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 2.0520 7.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -0.1230 7.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 -2.1810 8.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1820 -0.9560 9.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8420 1.1670 7.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5350 2.0710 6.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 0.8480 5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 31 2 0 0 0 0 30 46 1 0 0 0 0 31 32 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 M END