IBS-ZINC02090628 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.5900 1.5490 -0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 0.0690 -0.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7040 -0.0740 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -1.5180 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -1.9940 -0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -1.9950 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.5660 -1.6130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3250 0.0430 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -0.5730 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 0.8960 -4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 1.7690 -3.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -0.6370 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 2.1260 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 1.6760 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.9940 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 0.5580 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 0.2570 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -1.5790 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -2.1780 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -2.4350 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -2.6620 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -0.9570 -4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.2030 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -0.0960 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -0.5890 -2.8020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 0.3040 -2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 1.0350 -5.1550 O 0 5 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 3 1 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 12 24 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 27 -1 M END