NIH-ZINC04195892 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -0.4760 1.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.4360 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -1.9590 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -2.3230 0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8830 -1.8420 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -3.8180 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -4.4380 -0.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 -1.8660 -1.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 -1.3120 -1.2080 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 -0.9170 -2.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3450 -2.2760 -0.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6060 0.1590 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3930 1.3860 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 2.5390 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 2.4660 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 1.2380 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8440 0.0850 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -0.0280 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.0190 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -2.3660 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -2.3760 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -1.8880 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 1.4440 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 3.4980 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 3.3670 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 1.1800 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 -0.8730 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -4.4610 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -5.4200 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 33 34 1 0 0 0 0 M END