NIH-ZINC00424552 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -0.7580 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -2.1970 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -2.4550 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -3.8330 -3.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 -4.8140 -3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -4.5680 -2.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -6.1890 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -7.2600 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -8.5180 -3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -8.6680 -4.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -7.6380 -4.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -6.4160 -4.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -5.3370 -4.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -5.4750 -5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -4.0990 -4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -2.8060 -4.7180 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -0.7590 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -0.5260 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -0.7720 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -1.2500 3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -1.4840 2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 -1.2350 1.2390 C 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 0.5120 -0.3560 -0.8950 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 -3.1420 -0.6060 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.0680 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -2.3490 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -2.8870 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -2.3030 -2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -1.7650 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -7.1140 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -9.3760 -3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -9.6500 -4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -0.1530 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.5910 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -1.4420 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -1.8570 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 -1.4130 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END