NIH-ZINC06498229 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 0.7040 -0.4880 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -1.7920 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -2.5390 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -1.8680 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -2.4930 -0.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -0.5120 0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -3.9580 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -4.6390 0.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -6.0570 1.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9500 -6.3610 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -6.8920 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -6.7720 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -5.9150 -1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -6.0970 -2.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -5.5940 -2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -7.1010 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -7.5640 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -8.5900 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -9.1370 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -8.6820 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -7.6760 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -6.2730 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 -5.3380 2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -2.3800 2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.5000 -1.2590 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 0.1000 -4.4370 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -7.9360 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -6.5290 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -5.1900 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -8.9480 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -9.9300 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 -9.1250 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -7.3270 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.8240 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -0.1240 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.5900 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -0.1400 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -7.5040 2.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -7.5930 2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 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 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 34 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 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 43 44 1 0 0 0 0 M END