NIH-ZINC04195438 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.2030 -0.6770 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 1.9450 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 1.1250 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -0.4950 -0.0400 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 1.5380 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 1.6640 1.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 2.0280 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 2.2340 0.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3950 2.1790 2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8630 2.5980 2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4310 2.7490 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0200 1.6670 4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5410 1.8060 6.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4740 3.0260 6.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8870 4.1080 6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3690 3.9710 4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1380 3.2020 8.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4650 4.3060 8.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1480 1.9020 8.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7220 3.6540 8.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1030 5.0740 8.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2250 5.3220 9.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2730 4.3730 8.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8810 3.0130 9.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7930 2.6470 8.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7570 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 0.7840 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 2.4960 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8330 2.9400 3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3210 1.2280 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4240 1.8370 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9370 3.5490 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0720 0.7130 4.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0010 0.9600 6.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8340 5.0620 6.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9130 4.8180 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4550 5.3140 7.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2420 5.6960 8.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6160 6.3310 8.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8340 5.2080 10.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7440 2.3620 8.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4930 2.8910 10.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3890 1.6630 8.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2160 2.6380 7.0820 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 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 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END