NIH-ZINC02996240 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.1160 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.0550 -2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.0600 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -2.1940 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -2.3850 -1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -1.4300 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -0.2880 -3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.1120 -2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 -1.6280 -3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 -2.6230 -2.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 -0.7040 -3.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7590 -0.9000 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 0.2850 -5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2130 1.4730 -4.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6010 2.6250 -4.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 2.6120 -6.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 3.7840 -6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3910 4.9710 -6.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0130 4.9920 -4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6110 3.8210 -4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2340 3.8400 -2.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 5.1030 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.0400 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -1.3820 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.3580 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -2.9320 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -3.2700 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 0.4540 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 0.7690 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 0.0900 -4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 -0.9700 -3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8490 -1.8200 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2320 0.0980 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 0.4090 -5.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 1.6860 -6.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6710 3.7730 -7.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6990 5.8850 -6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0260 5.9200 -4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6040 5.8010 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9450 4.9780 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2870 5.4940 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 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 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 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 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END