IBS-ZINC00543680 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.0070 1.4610 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -0.0420 -0.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3780 -0.5440 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -0.4870 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.0990 2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.5210 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -0.0620 1.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2920 1.0310 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.4850 -0.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -0.6500 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 0.5910 3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 0.9840 3.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 0.8070 4.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 1.5770 5.7220 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3100 1.2270 5.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 3.0700 5.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 1.3640 6.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 0.7200 6.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 1.7540 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 1.7450 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 2.0480 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.5830 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -0.1100 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -1.6160 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.1420 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -0.3490 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -0.3170 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -1.7440 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 0.4160 4.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 3.6470 6.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 3.2940 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 3.4390 5.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 1.8370 8.0480 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 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 9 1 0 0 0 0 7 10 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 M CHG 1 33 -1 M END