IBS-ZINC05246880 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -0.8650 -1.1780 P 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -0.3050 -2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.8060 -1.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -1.2660 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -1.7240 0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -1.2170 0.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 -1.6910 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 -1.6910 1.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -2.1800 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 -2.6140 3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -2.3520 2.7050 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -2.3950 -1.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -3.3640 -2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -0.4400 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -0.8510 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 -2.2250 3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -3.0460 4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -3.0350 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -3.4740 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -4.3220 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 19 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 20 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 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 M END