NCID-ZINC05461716 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 1.4930 2.6600 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 1.3010 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 0.3150 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.5110 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 0.7450 -1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 0.4280 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 0.5640 -0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 -0.0830 -2.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -0.5420 -2.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4340 0.0590 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 -2.0390 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -2.3640 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -4.1350 -0.4680 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 -4.1500 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 -0.2790 -4.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -0.3500 -4.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2580 0.0050 -4.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 0.4150 -5.7480 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0950 -0.0950 -6.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6770 1.9440 -5.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 2.5400 -5.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 3.2010 -4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 3.7410 -4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 3.6290 -5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 2.9740 -7.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 2.4310 -7.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2130 0.0670 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8400 -0.1840 -4.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 2.5640 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 3.3190 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 3.1560 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 0.6600 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.6750 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 0.1780 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 2.1830 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 0.5630 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 1.9330 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -0.1300 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -2.6200 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 -2.3480 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5130 -1.7740 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -2.1430 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -5.1650 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -3.4830 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -3.8420 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 -0.0700 -3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 2.4260 -5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1740 2.2390 -6.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 3.2890 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 4.2430 -3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 4.0470 -6.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 2.8810 -8.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 1.9150 -7.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 0.0800 -7.1620 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 M CHG 1 54 -1 M END