NIH-ZINC00371890 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 0 0 0 0 0999 V2000 0.1660 1.2200 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.2710 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -0.5870 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -0.2780 -2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 1.2230 -2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 1.7620 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.3300 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 1.7820 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 1.4860 -4.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 2.6670 -4.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 3.5930 -4.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 2.6790 -6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 3.9640 -6.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 3.9900 -8.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 2.9660 -8.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.8130 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 1.3820 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -0.8120 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -0.6850 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -1.6630 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -0.0830 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -0.8080 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -0.7300 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 1.7980 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 1.4570 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 2.8590 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 0.2480 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 1.7630 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 2.8780 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 1.5030 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 0.7830 -4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 2.5320 -6.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 1.8180 -6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 4.1110 -6.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 4.8220 -6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 5.0530 -8.8500 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 M CHG 1 36 -1 M END