CHEMDIV-ZINC04932677 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.5220 0.4930 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -0.1280 0.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -0.7210 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -1.1910 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -1.8110 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -1.9610 -3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -1.5130 -2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -0.8910 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -2.5920 -4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -2.1420 -5.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -3.1720 -6.5870 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -4.0670 -5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -3.6710 -4.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 -5.0790 -5.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 -5.8080 -4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 -6.9740 -4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -7.1120 -4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -0.9550 -6.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 0.3090 -5.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 1.5470 -6.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 1.4080 -7.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -0.2490 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 1.2710 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.9730 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -1.0690 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.1730 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -1.6380 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -0.5560 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 -5.3250 -6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -5.1570 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -6.1900 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -7.7620 -5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7510 -6.3570 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -7.9900 -4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -1.1190 -7.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.8380 -5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 0.5090 -4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 0.1810 -6.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 2.5740 -6.5640 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 M CHG 1 39 -1 M END