NIH-ZINC04197101 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 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 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8050 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.5560 -0.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -2.3060 -2.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -3.7580 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -4.1270 -3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -3.2300 -5.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -1.7780 -4.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -1.4090 -3.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -3.7310 -6.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -4.9320 -6.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -2.8000 -7.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -3.5830 -8.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -4.0810 -9.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -3.9070 -8.1720 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 -4.1590 -9.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 -2.8970 -7.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 -5.4240 -7.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -6.6230 -7.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -7.8160 -7.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -7.8120 -5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 -6.6050 -5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -5.4130 -5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -6.5960 -3.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 -5.3210 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 -8.9840 -5.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -10.1840 -6.0430 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 0.5290 -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 2.5790 -4.0440 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -4.2770 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -5.1600 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -4.0080 -3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -1.2600 -5.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -1.4920 -4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.3770 -3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -1.5240 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -2.1800 -7.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 -2.1630 -6.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -3.3400 -10.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 -5.0110 -9.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -4.2610 -8.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -6.6280 -9.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 -8.7510 -7.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3390 -4.4750 -5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 -5.4560 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 -4.7120 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 -4.8220 -3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -10.2660 -6.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4010 -10.1560 -6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -11.0440 -5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 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 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M END