NIH-ZINC06073502 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.3590 1.6210 1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 0.3490 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.5160 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -1.6660 1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -2.7910 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -2.9230 0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -3.8190 2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -5.0940 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -5.8190 1.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -7.0770 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -7.9920 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -9.2150 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -9.5750 2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -8.6920 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -7.4580 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -6.1100 3.6450 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -5.2810 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -4.9360 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -4.3750 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -3.9660 -3.0500 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -2.8620 -2.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -5.1480 -3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -3.1280 2.6760 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -1.6000 1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -0.2570 2.0140 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 2.0500 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 2.2420 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -0.0800 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -0.8670 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 0.0650 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -7.7310 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -9.9040 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -10.5380 3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -8.9630 4.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -6.0260 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -4.3820 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -4.1910 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -5.8350 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -5.1200 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -3.4750 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -3.4240 -4.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -3.1590 -4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 41 42 1 0 0 0 0 M END