IBS-ZINC03982454 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 83 0 0 1 0 0 0 0 0999 V2000 6.9740 -1.4930 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 -0.7550 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 -0.8140 1.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5070 -0.2570 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -0.1970 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 1.2950 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 1.8870 -1.6150 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7790 1.3400 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 1.7740 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 3.3600 -1.6750 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3320 3.8130 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 4.1140 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 4.6320 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 3.6870 -0.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3830 2.7320 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 3.4860 -1.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6200 4.7500 -2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 5.1530 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 5.4930 -0.5890 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4700 6.2770 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8670 4.2500 0.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6190 3.4900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 4.6200 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 5.2180 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0090 5.8280 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5940 5.9820 -0.3030 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7240 7.4600 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1460 7.9370 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4150 7.8310 1.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4040 8.2330 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3520 6.4110 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4270 8.5770 1.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5600 5.1930 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 2.2410 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -2.2720 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 -2.8890 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -2.3310 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7020 -2.5470 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 -1.0590 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0600 -1.3990 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 -1.2270 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 0.2860 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 -0.6920 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -0.3260 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 1.8040 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 1.4270 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 2.1300 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 0.7320 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 2.3780 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 4.9530 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 3.4390 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 5.6610 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 4.5500 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 4.5590 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 5.5620 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7290 4.3260 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 6.0260 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 5.3440 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 3.7240 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6990 5.1380 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5190 7.5820 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0110 8.0480 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8600 7.3170 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2550 8.9750 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4630 6.3500 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1560 5.8560 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5360 8.5540 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3110 5.3590 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5800 5.5270 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4780 4.1300 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7440 2.1390 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0260 2.3380 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5870 1.3590 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -2.8290 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -2.3320 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -3.9270 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -2.8460 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -1.8920 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -3.3700 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -1.7740 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 35 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 2 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 33 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 27 62 1 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 33 68 1 0 0 0 0 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