ANALYTICONDISCOVERY-ZINC04221468 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 82 0 0 1 0 0 0 0 0999 V2000 0.7450 -2.6420 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -1.3690 0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.2270 1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 0.0930 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 0.8080 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -0.1180 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 0.1760 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.7280 -2.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 1.4480 -2.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 1.7560 -3.8450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0800 1.0990 -4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 3.2470 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 3.5420 -5.4710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0000 3.4550 -6.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 2.5480 -5.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 1.6680 -4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 2.4530 -6.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 3.1760 -7.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 1.4500 -7.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2950 1.4960 -6.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 0.0450 -7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -0.0200 -8.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 0.3020 -9.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 1.7080 -9.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 1.7730 -8.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3050 1.0480 -8.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 3.1580 -8.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 3.8210 -7.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 3.6590 -9.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 2.9650 -10.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 3.6320 -10.8480 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3870 3.2180 -10.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 5.1110 -10.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 4.9900 -9.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1380 5.0930 -8.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 6.0550 -9.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 5.7410 -9.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 3.4990 -12.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2990 2.3960 -12.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6760 1.5130 -12.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4850 2.2600 -14.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1560 0.9850 -14.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9150 2.3130 -14.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 4.9310 -5.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 5.0860 -5.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -2.9800 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -2.5060 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -3.3870 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -2.0350 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 0.5190 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.8820 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 2.1600 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 3.3820 -4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 3.8760 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 2.0290 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 0.6430 -4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -0.6810 -7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -0.1850 -6.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -1.0220 -8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 0.7050 -8.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -0.4230 -9.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 0.2560 -10.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 1.9380 -10.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 2.4340 -9.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 1.9020 -10.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4350 3.1080 -11.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2350 5.6230 -10.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7100 5.6260 -11.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 4.2050 -12.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 2.6980 -14.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4620 0.2440 -14.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8100 0.5840 -15.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0690 2.7850 -15.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7220 2.4460 -14.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 7.3520 -9.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 5.9960 -5.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 6.8660 -5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 7.9980 -9.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 49 1 0 0 0 0 4 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