NIH-ZINC03045559 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 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 -1.0200 -0.3810 0.0100 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 0.0170 -0.9450 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -1.4030 3.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.4200 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -0.9780 2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.5240 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.6080 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.3360 -2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -1.0940 -3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -1.1530 -4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -1.6250 -5.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -2.1410 -7.2710 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -2.4960 -8.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -3.0420 -6.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.7470 -7.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 0.0610 -8.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 1.1550 -9.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 1.4420 -8.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 0.6300 -7.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -0.4660 -7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 2.5180 -9.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7290 2.7520 -8.7920 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 -1.0620 -0.9330 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -1.7480 4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -1.7760 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -0.9900 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -0.1830 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -0.6950 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -0.4090 -3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -2.0890 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -1.8380 -4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -0.1580 -4.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -1.6360 -6.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -0.1620 -9.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 1.7860 -10.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 0.8510 -7.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -1.1010 -6.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 1.8910 -8.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 2.9070 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 3.6390 -9.2560 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 10 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 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 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M END