IBS-ZINC04468452 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7280 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.2270 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.0790 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.4510 3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.9660 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.1120 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.4210 -0.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.7100 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.2220 -2.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.0830 -3.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -3.5300 4.7850 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -4.7560 4.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -2.7820 5.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -3.8520 5.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 0.8410 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -0.6730 4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -4.0350 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.0440 -3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.7190 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -3.4580 4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -4.4350 5.9380 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 M END