IBS-ZINC02201117 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -0.9860 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -0.6220 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 0.5940 -3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 1.3140 -4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 2.4980 -3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 3.3880 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 3.0730 -5.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 1.9450 -6.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 1.0770 -5.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 4.5760 -4.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 5.4990 -4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 6.7230 -4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 7.6860 -4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7660 9.9130 -4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0550 8.4930 -3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 2.5150 -2.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 1.4060 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 1.0030 -1.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -1.5050 -4.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -2.5400 -4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -3.1530 -3.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -2.2770 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -3.6040 -5.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -1.8480 -4.7530 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 1.7260 -7.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 4.7970 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 5.8150 -5.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 4.9960 -5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5430 6.4070 -3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 7.2260 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2430 8.0020 -5.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7250 7.1840 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6710 9.5290 -5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0570 10.2160 -5.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0150 10.7710 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 7.7650 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9710 8.0590 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 9.3820 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -2.0170 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -0.8950 -5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -2.0690 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -2.7560 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -3.1320 -6.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -4.3400 -5.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 -4.0990 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -1.0970 -3.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -2.5880 -4.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -1.3680 -5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1640 8.8620 -4.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 23 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 2 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 21 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 63 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 63 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 63 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 M END