NIH-ZINC04004388 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1190 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6960 -2.5130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8260 -2.2980 -3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -4.2390 -2.4650 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0740 -4.5830 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -4.6900 -3.6350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6890 -5.2820 -3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -3.3660 -4.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7230 -3.0710 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.3980 -3.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -3.5060 -4.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -3.4160 -6.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 -3.5450 -6.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3400 -3.7710 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5030 -3.8900 -5.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -3.8540 -4.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 -4.0080 -3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -3.7160 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -3.8160 -2.1220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -5.4470 -4.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -6.3910 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -6.5780 -5.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -7.2170 -6.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -4.7310 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -4.9050 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -4.6540 -0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -5.4130 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.4460 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.4700 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -3.2430 -6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 -3.4760 -7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -6.7240 -7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -8.2040 -6.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -7.3220 -6.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -5.5820 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -4.6750 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -6.3490 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 42 1 0 0 0 0 31 43 1 0 0 0 0 31 44 1 0 0 0 0 M END