IBS-ZINC00709092 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.3260 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -3.6920 -2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -4.5510 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -4.0350 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.6680 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -5.9380 -1.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -6.6280 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -7.9580 -2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -8.0950 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -6.7980 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -6.6030 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -7.6790 -2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -8.9650 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -9.1750 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -10.0170 -2.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -9.7270 -2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 -11.0060 -2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -12.0570 -2.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -10.9760 -2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6890 -12.2460 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2000 -12.0140 -3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -9.0370 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -9.6160 -1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 -9.3860 -3.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -10.4620 -3.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -10.7150 -4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -6.0200 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -1.6580 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -4.0930 -3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -4.7020 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.2660 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -5.6090 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -7.5220 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -10.1740 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -9.2660 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -9.0440 -3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 -12.6940 -4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 -12.9150 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4260 -11.3440 -4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7070 -12.9670 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5430 -11.5660 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 -10.1840 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -11.3690 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -9.8090 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -11.5230 -4.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -10.9940 -5.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -6.0020 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -6.6160 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -5.0020 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END