ANALYTICONDISCOVERY-ZINC08299905 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -0.0480 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 0.6530 2.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -0.3920 1.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 0.0800 2.6820 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7670 1.0780 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 0.0520 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 -0.1000 3.9360 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4570 0.8700 4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3430 -1.0450 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7430 -1.5040 2.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9500 -1.3880 5.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6620 -0.9200 6.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7520 -0.6180 7.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5640 -0.1600 8.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2700 0.0110 8.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 -0.2800 8.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3670 -0.7420 6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -1.0080 6.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 -1.5160 6.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -0.6910 4.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -0.9140 3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0640 0.4980 10.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0460 0.8110 11.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6070 1.2450 12.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 1.2900 12.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 0.7530 11.0980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 0.0240 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 0.7190 -0.3610 O 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -0.9520 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.9840 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -0.8010 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6700 -2.0340 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7560 -0.7470 6.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4170 0.0690 9.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1770 -0.1490 8.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9150 -1.9390 3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -0.6990 4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 0.7280 10.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2870 1.5290 13.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 1.6040 13.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -0.2830 -2.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 0.0740 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 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 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 56 57 1 0 0 0 0 M END