NIH-ZINC00453484 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 1.2790 1.2230 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -0.1370 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.6980 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -1.9450 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.6370 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.0730 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.8180 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7680 -2.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -2.0940 -3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -0.8810 -3.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.8470 -4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -1.8950 -5.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.3430 -6.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -2.0210 -6.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -1.4730 -7.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -0.2510 -7.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 0.4270 -7.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.1180 -7.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -1.4720 -6.5620 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -1.1830 -7.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -2.5440 -6.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 0.0400 -5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -3.8640 -0.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -4.3800 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 1.1110 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 1.7250 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 1.8160 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -0.1590 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -2.3800 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -0.3760 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -3.7350 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -3.4610 -5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -3.4860 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -2.9760 -5.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -2.0000 -7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 0.1760 -8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 1.3820 -8.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 0.4100 -7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 0.7550 -5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 0.4750 -6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -0.2010 -4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -5.3640 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -4.4660 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -3.7060 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 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 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END