IBS-ZINC04764874 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.0460 1.4900 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.0380 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -0.4780 0.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -1.1750 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -1.8390 1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -2.5000 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -2.5700 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -1.9700 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -1.2280 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -0.5670 -1.4320 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5960 -0.3920 -2.8180 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1140 -2.0550 -2.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -3.3170 -1.1810 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0590 -3.4800 -2.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -3.7660 -0.4420 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.6000 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 1.8800 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.8060 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 1.8740 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -1.8160 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -2.9950 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -2.6110 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -1.5580 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -0.3000 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -1.6880 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.2120 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 16 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 M CHG 1 10 1 M CHG 1 11 -1 M CHG 1 13 1 M CHG 1 15 -1 M END