IBS-ZINC03982452 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 83 0 0 1 0 0 0 0 0999 V2000 1.3810 -1.1450 1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.3940 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -0.6240 -0.5570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2690 -0.0950 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -0.1000 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 1.4190 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 1.9290 -0.5770 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4040 1.3990 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 1.6850 -1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 3.4280 -0.2710 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3470 3.9820 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 3.7070 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 4.3550 1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 4.9860 1.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1600 5.1670 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 3.9110 -0.0870 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8840 4.4210 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 5.6800 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 6.7540 -0.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3350 6.9140 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 6.2740 0.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6030 7.0430 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 6.0070 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 7.2560 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 8.1620 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 8.0560 -1.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0120 8.2670 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 9.5710 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 9.4730 -3.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4000 10.3780 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 9.3790 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 8.3400 -3.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 9.2070 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 2.7460 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -2.1220 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.6460 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -2.3510 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -2.2140 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -0.7980 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -0.9570 2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -0.7620 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 0.6720 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.5600 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.3490 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 1.8850 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 1.6720 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 1.9280 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 0.6380 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 2.3160 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 4.3910 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 2.7740 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 5.1260 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 3.6000 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 4.6510 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 3.6460 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 6.0350 -2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 5.4570 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 5.2000 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 5.7280 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 7.4090 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 8.3220 -2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 7.4330 -3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 10.3980 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 9.7470 -4.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 9.2360 -1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 10.2680 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 8.2150 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 9.2130 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 10.1530 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 9.0750 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 1.9830 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1240 3.1050 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 2.3180 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -2.6510 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -2.1170 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -3.7120 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -2.4820 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -1.9780 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -3.4180 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -1.8220 -2.9950 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 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