IBS-ZINC04728940 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.2230 1.5180 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 0.0190 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -1.9750 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -2.4200 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -2.0170 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -0.5120 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -0.0680 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -2.3930 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -2.6770 5.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -2.3810 4.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -2.6150 5.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -2.1570 3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 2.0800 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 1.8360 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 1.7990 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -0.4920 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -0.2680 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -2.4500 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -2.1990 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -1.9850 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -3.5080 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -2.5640 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 0.0460 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -0.2410 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 1.0200 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -0.5260 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.4770 1.1310 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2680 -0.0460 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 27 1 M END