NIH-ZINC00434330 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 3 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -1.0140 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -1.4440 2.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -1.3910 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -0.9140 3.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.4590 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 0.0350 2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 0.0450 3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 0.6250 3.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -0.2040 3.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 0.3280 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 1.6880 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 2.5160 4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 1.9840 4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -1.0730 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -1.6120 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 -1.5980 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -0.4960 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 -0.4830 -3.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 -1.5720 -4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 -2.6750 -3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -2.6890 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 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 2.5510 -1.7480 4.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -0.9740 4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 0.6520 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -1.2660 3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 -0.3190 3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 2.1040 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 3.5790 4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 2.6310 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -1.0080 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -2.6370 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 0.3550 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 0.3780 -3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 -1.5620 -5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -3.5260 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 -3.5520 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.4640 0.0080 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 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 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 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 26 45 1 0 0 0 0 M END