IFLAB-ZINC05241537 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -2.3420 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -3.1560 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -4.5200 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -5.0940 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -4.2740 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -2.9110 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -6.5610 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -7.2720 -1.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -7.1130 0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -8.4910 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -9.1500 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -10.5950 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -10.9850 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -9.5960 -0.8590 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -12.4320 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -13.3120 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -12.9490 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -11.5640 2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -8.4660 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -8.1910 2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -8.1400 3.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -2.7120 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -5.1500 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -4.7150 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -2.2780 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -6.5450 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -12.7210 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -12.5520 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -14.3610 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -13.1430 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -12.9380 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -13.6850 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -11.6130 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -11.2250 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -8.3590 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -7.6870 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END