NCID-ZINC05492878 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 78 0 0 1 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -0.0730 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -0.5660 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -0.1420 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 -0.6350 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 -0.2110 -3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 -0.7040 -4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7430 -0.2800 -4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4590 -0.7730 -6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9280 -0.3490 -6.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6440 -0.8420 -7.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -0.4180 -7.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8190 -0.9040 -8.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2070 -1.5280 -9.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1300 -0.6450 -8.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8160 -1.1170 -9.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2630 -0.6990 -9.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6800 -0.0680 -8.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0930 -1.0260 -10.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 19.5000 -0.6190 -10.7880 C 0 0 3 0 0 0 0 0 0 0 0 0 19.8530 -0.6510 -9.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6400 0.8040 -11.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0190 1.1770 -11.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8430 0.3500 -12.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 21.4790 0.3850 -13.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7910 -1.0910 -11.6530 C 0 0 3 0 0 0 0 0 0 0 0 0 22.1920 -1.1330 -10.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3370 -1.5720 -11.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 20.2870 -2.5780 -11.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8320 -1.5810 -12.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 22.5690 -1.9300 -12.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1900 0.8250 -12.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 23.3670 2.1260 -12.6820 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.5840 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.0140 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -0.5060 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -1.6530 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -0.1330 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 0.9450 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 -0.5750 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 -1.7220 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -0.2020 -4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 0.8760 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 -0.6440 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 -1.7910 -4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -0.2710 -5.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 0.8070 -4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2170 -0.7130 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3970 -1.8600 -6.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9850 -0.3400 -6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9910 0.7380 -5.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4020 -0.7820 -5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5820 -1.9290 -7.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1710 -0.4090 -8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1760 0.6690 -7.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5870 -0.8510 -6.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6190 -0.1450 -7.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7530 -2.2040 -9.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3420 -0.6840 -10.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7590 -1.5300 -11.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2470 0.8450 -12.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0800 1.4930 -10.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3160 -2.1650 -13.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5020 -1.6800 -12.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0650 2.1140 -13.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 22.7550 2.8440 -12.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 24.4160 2.4140 -12.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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