IBS-ZINC05047178 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.0510 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -4.5110 -3.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -5.8470 -3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -6.5990 -3.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 -6.3730 -5.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -6.7110 -6.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -7.2120 -7.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -7.5980 -8.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -7.5300 -8.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -7.9410 -10.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -7.8680 -10.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -7.3900 -9.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -6.9840 -8.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -7.0450 -8.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -6.6480 -6.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5210 -7.1600 -6.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -6.6680 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -6.4890 -4.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 -7.5740 -6.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 -6.3790 -7.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9440 -5.9400 -8.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9290 -6.8120 -8.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8570 -5.6120 -7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 -4.5950 -7.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 -5.3910 -6.4700 O 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 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -4.4120 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.4280 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -8.3130 -10.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -8.1840 -11.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -7.3420 -10.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -6.6160 -7.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -6.1340 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -6.7180 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -7.9400 -5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -8.3680 -7.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2900 -7.7070 -7.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 -6.9850 -9.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6770 -5.9130 -7.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2410 -5.1910 -8.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4900 -4.0770 -6.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 -3.8800 -7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END