NIH-ZINC00617477 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8320 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0610 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.1210 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.0640 -1.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 -0.0050 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 1.1220 -1.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -0.2120 -3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -1.5040 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -1.6910 -5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -0.6020 -6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 0.6800 -5.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 0.8870 -4.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 2.1470 -4.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -1.9620 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -2.3560 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 -2.6900 -6.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -0.7570 -7.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 1.5240 -6.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 2.4680 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 19 30 1 0 0 0 0 M END