NCID-ZINC05439482 MOE2007 3D CORINA 3.40 0006 02.08.2006 77 82 0 0 1 0 0 0 0 0999 V2000 0.9290 2.3800 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 1.1090 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 1.4860 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 0.3370 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 0.1120 2.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -0.1000 2.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -0.9090 3.9030 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2910 -1.1860 3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -2.1800 3.9430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6870 -1.9430 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -2.5660 5.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7770 -3.4070 5.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -3.5500 7.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -2.1950 8.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7460 -1.7330 7.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -1.2700 7.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3050 -1.6880 7.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -1.2010 6.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8620 -0.1540 5.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5080 0.6590 5.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -0.1940 5.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 0.1060 8.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.0440 9.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -1.5110 10.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3520 -1.8430 9.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -2.3530 9.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4580 -3.8150 9.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -3.9620 11.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -3.0840 12.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6770 -3.3980 11.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -1.6680 11.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -3.2200 13.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -4.1880 14.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -4.8980 13.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -4.3890 15.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -1.9130 10.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -3.2670 5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -3.2720 3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -4.4810 2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -5.4550 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -5.2190 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -6.0780 0.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -4.0490 1.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -3.0880 2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 2.9970 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 2.9380 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 2.1120 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 0.4920 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 2.1020 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 0.5800 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 2.0430 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -2.9110 5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -4.3920 5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -4.1860 7.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -4.0160 7.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 0.7700 7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 0.5210 7.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 0.5660 10.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 0.2840 10.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -4.4390 9.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -4.1280 9.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -3.6510 11.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -5.0030 11.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -1.0540 12.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -1.3490 12.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -3.6620 16.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -5.3970 15.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -4.2550 15.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -2.5320 9.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -2.0250 11.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.8690 9.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -2.6460 5.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -3.4270 6.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -4.2280 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -4.6370 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -6.3930 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -2.1540 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 48 1 0 0 0 0 3 49 1 0 0 0 0 3 50 1 0 0 0 0 3 51 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 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