IBS-ZINC05119898 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5440 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 1.3980 -0.3600 -0.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9650 -0.9040 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 0.8760 -0.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 1.8890 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -1.2130 -1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -1.6460 -2.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -2.4360 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -2.8520 -3.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 -3.6440 -4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -3.9730 -5.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -3.5580 -5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -2.8110 -4.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -4.0150 -6.0160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 -4.0840 -5.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 -2.4620 -3.0810 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6150 -3.1680 -2.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -1.4350 -3.3740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5140 1.9310 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 1.9210 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -0.3930 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -0.3930 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 2.8820 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 1.8220 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -2.0880 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -0.6250 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 -1.3800 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -3.8400 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -4.6350 -6.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END