MAYBRIDGE-ZINC01048683 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0240 -0.8310 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1790 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -1.9720 -0.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7970 -1.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.4840 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -3.6210 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -4.8380 3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -5.9200 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -5.7900 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -4.5760 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -6.9530 0.7620 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2920 -8.0230 1.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -6.8400 -0.2810 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0330 -0.4650 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -0.3280 3.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.2820 3.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 0.0190 4.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 0.2170 5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 0.0950 4.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.5830 6.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 0.7880 7.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 1.1300 8.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 1.2670 9.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 1.0650 8.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 0.7300 7.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.7770 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -4.9450 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -6.8710 3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -4.4740 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 0.1170 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 0.6810 6.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 1.2890 9.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 1.5340 10.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 1.1740 8.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 0.5760 6.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 16 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 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 26 2 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END