NCID-ZINC05545103 MOE2007 3D CORINA 3.40 0006 02.08.2006 90 94 0 0 1 0 0 0 0 0999 V2000 4.4570 -3.3510 2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -4.0430 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 -3.0190 4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -2.6480 4.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -3.9400 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -4.9870 4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -5.2080 3.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -6.1190 2.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -4.5820 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -6.3240 4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -0.8590 6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -1.6190 6.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -2.2480 7.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -2.2150 8.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -3.0800 7.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -3.8680 9.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -4.8080 9.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0450 -4.9310 10.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -4.2350 8.8300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0710 -4.9770 8.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -2.9480 9.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0610 -2.4140 8.9070 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7980 -3.2250 9.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 -2.1620 7.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3970 -3.4590 6.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -4.0100 7.3250 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8900 -3.1110 7.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -2.4370 5.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -5.2950 6.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -4.0820 5.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 -1.6180 6.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3390 -1.6020 5.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -1.0150 7.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 -0.8050 8.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9980 -0.2180 9.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2140 0.1380 9.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4210 -0.0770 7.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -0.6460 7.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -0.8240 5.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 -1.1660 9.6320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6980 0.0540 9.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -1.5660 10.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -6.6770 8.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 -7.2780 9.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -3.9020 10.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -4.5500 3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 -2.6060 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -4.0630 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -2.8140 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -3.4340 5.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 -2.1110 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -2.1330 4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -4.3780 6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -3.7200 5.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -6.8590 3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -3.5720 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -5.2710 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -4.6020 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -6.2030 4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -7.1070 3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 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10.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -8.2220 8.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -3.2350 9.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7650 -3.7160 3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 -5.0830 4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -5.2330 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -1.7210 6.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -2.2190 6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -6.2270 8.8250 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1220 -6.1630 7.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 50 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 52 1 0 0 0 0 4 87 1 0 0 0 0 5 6 1 0 0 0 0 5 53 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 55 1 0 0 0 0 9 56 1 0 0 0 0 9 57 1 0 0 0 0 9 58 1 0 0 0 0 10 59 1 0 0 0 0 10 60 1 0 0 0 0 10 61 1 0 0 0 0 11 12 1 0 0 0 0 11 62 1 0 0 0 0 11 63 1 0 0 0 0 11 87 1 0 0 0 0 12 13 1 0 0 0 0 12 64 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 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