IBS-ZINC03982451 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 83 0 0 1 0 0 0 0 0999 V2000 1.1650 -0.5610 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 0.1970 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -0.2400 -0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0110 0.2720 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 0.1160 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 1.6380 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 1.9920 -0.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3410 1.4930 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 1.5320 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 3.5020 -0.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4710 4.0290 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 4.0050 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 4.9140 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 5.2340 0.3720 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7600 5.9050 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 3.8460 -0.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1290 3.9390 -1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4070 4.7830 -1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 5.1420 -0.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0020 4.2040 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 5.8780 0.6150 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9200 5.9020 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 7.3220 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 7.9890 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 7.3350 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 5.8440 -0.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0190 5.4590 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3620 6.1830 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1640 7.6980 -1.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 12.1390 8.1880 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3600 8.1250 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4670 8.0870 -2.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8370 5.3270 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0870 2.7840 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -1.7520 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -2.1090 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.1890 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -1.6310 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -0.3500 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -0.2410 3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -0.0230 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 1.2680 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -0.3170 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -0.2800 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 2.0640 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 2.0430 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 1.6540 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 0.4830 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 2.1330 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 4.5840 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 3.1620 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 5.8300 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 4.4010 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 2.9310 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 4.3820 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2240 4.2220 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 5.7040 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 7.3040 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 7.8790 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 9.0650 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 4.3800 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5040 5.7250 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9230 5.8880 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9480 5.9020 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 9.1920 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9340 7.9300 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3070 9.0390 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9620 4.2460 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8140 5.8000 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2260 5.5680 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 1.8200 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1220 3.0580 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 2.7160 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -2.2640 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -1.5960 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -3.1860 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -1.7970 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -1.9350 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -3.2660 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -1.6770 -2.2880 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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