IBS-ZINC02287550 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -2.6260 0.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -2.6890 2.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -4.1610 2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -4.6270 3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -5.7380 3.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -3.8380 4.6950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -2.5820 4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -1.9160 5.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -1.9800 3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -4.5560 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -4.5050 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -4.1930 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -2.0980 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -0.9220 3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 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 23 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 M END