IBS-ZINC00727902 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0950 1.5060 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.0130 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.6210 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.0170 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7090 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -2.0090 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -2.6080 0.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6750 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 0.0450 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 0.3990 1.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 1.6370 2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 1.9190 3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 0.9630 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -0.2040 3.8210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -0.5040 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -4.1980 0.3830 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7440 -4.6510 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -4.7730 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -3.9830 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -2.6540 -0.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -4.5560 -0.9600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -6.1830 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -7.3010 -0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.4980 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -4.0200 2.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -4.2920 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -5.0470 4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -5.5290 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -5.2470 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -6.2700 4.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -6.7310 3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -5.3160 5.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -4.7900 6.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 1.8780 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.7350 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 1.9830 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.0600 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 0.9580 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -0.5870 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 2.3640 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 2.8730 3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 1.1750 5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -1.4690 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -5.5140 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -4.0030 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -3.4320 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -3.9170 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -5.6160 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -7.3080 3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -5.8760 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -7.3610 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -5.1880 6.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -3.7030 6.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -5.0770 7.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 3 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 M END