CHEMDIV-ZINC01056201 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5280 -1.7820 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -0.3180 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 -1.0020 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 -1.3080 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 -1.0060 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -1.2930 2.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -0.3290 1.2040 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9960 -0.6530 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 1.1240 1.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 1.8290 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 3.0940 0.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 3.2350 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 2.0560 1.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 4.5170 2.2360 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4860 5.5610 1.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 4.5290 2.9600 O 0 5 0 0 0 0 0 0 0 0 0 0 6.4720 -1.3330 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 -2.6060 -2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 -2.6370 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 -1.4370 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -0.1810 -3.6860 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -0.6260 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 0.7620 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 -1.7960 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 1.4230 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 -3.4940 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6270 -3.5610 -4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 -1.2850 -5.6530 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 27 2 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END