IBS-ZINC05562531 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 0.2500 1.4720 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.0980 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -0.6720 -0.0110 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4030 -0.1690 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 1.1940 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 2.0430 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 3.4260 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -2.1270 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -2.6300 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -2.2800 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -4.4530 -1.4680 P 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -4.9330 -2.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -1.9920 -2.2740 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -2.4670 -1.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 2.0960 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -0.3540 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -0.8350 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 1.5990 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 4.0040 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 3.8100 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -2.5940 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -2.3850 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -5.0170 -1.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -4.9750 -0.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -0.3820 -2.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.5210 -3.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -2.2190 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 0.0000 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -5.9380 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -4.6810 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 23 30 1 0 0 0 0 24 29 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 3 1 M END