NIH-ZINC02853901 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.0280 1.5310 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0020 0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5130 -0.3420 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.5270 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -1.2420 0.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.2060 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -0.7730 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -1.0320 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -1.5920 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 -1.8950 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 -1.6400 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -1.0740 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6710 -2.6100 -1.1820 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 -3.2950 -2.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 -3.2460 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7580 -1.3630 -1.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -0.4870 1.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -0.8490 1.0980 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -1.2570 2.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -1.6650 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 0.6550 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 1.4410 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 2.6220 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 3.0160 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 2.2300 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 1.0470 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.9140 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.8950 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.8750 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 0.4180 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -0.7950 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0210 -1.7940 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8310 -1.8780 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -0.8700 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6060 -1.4850 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5480 -0.5110 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.5970 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 1.1330 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 3.2360 2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 3.9380 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 2.5380 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 0.4310 -1.3560 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 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END